Home Cart 0 Sign in  
X

[ CAS No. 75853-49-5 ] {[proInfo.proName]}

,{[proInfo.pro_purity]}
Cat. No.: {[proInfo.prAm]}
3d Animation Molecule Structure of 75853-49-5
Chemical Structure| 75853-49-5
Chemical Structure| 75853-49-5
Structure of 75853-49-5 * Storage: {[proInfo.prStorage]}

Please Login or Create an Account to: See VIP prices and availability

Cart0 Add to My Favorites Add to My Favorites Bulk Inquiry Inquiry Add To Cart

Search after Editing

* Storage: {[proInfo.prStorage]}

* Shipping: {[proInfo.prShipping]}

Quality Control of [ 75853-49-5 ]

Related Doc. of [ 75853-49-5 ]

Alternatived Products of [ 75853-49-5 ]
Product Citations

Product Details of [ 75853-49-5 ]

CAS No. :75853-49-5 MDL No. :MFCD10000650
Formula : C14H28O Boiling Point : -
Linear Structure Formula :- InChI Key :OQWNKUAZQSLNSR-UHFFFAOYSA-N
M.W : 212.37 Pubchem ID :3018619
Synonyms :

Calculated chemistry of [ 75853-49-5 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 15
Num. arom. heavy atoms : 0
Fraction Csp3 : 0.93
Num. rotatable bonds : 11
Num. H-bond acceptors : 1.0
Num. H-bond donors : 0.0
Molar Refractivity : 69.61
TPSA : 17.07 Ų

Pharmacokinetics

GI absorption : High
BBB permeant : Yes
P-gp substrate : No
CYP1A2 inhibitor : Yes
CYP2C19 inhibitor : No
CYP2C9 inhibitor : No
CYP2D6 inhibitor : No
CYP3A4 inhibitor : No
Log Kp (skin permeation) : -3.56 cm/s

Lipophilicity

Log Po/w (iLOGP) : 3.54
Log Po/w (XLOGP3) : 5.68
Log Po/w (WLOGP) : 4.74
Log Po/w (MLOGP) : 3.8
Log Po/w (SILICOS-IT) : 4.91
Consensus Log Po/w : 4.53

Druglikeness

Lipinski : 0.0
Ghose : None
Veber : 1.0
Egan : 0.0
Muegge : 2.0
Bioavailability Score : 0.55

Water Solubility

Log S (ESOL) : -4.01
Solubility : 0.0208 mg/ml ; 0.0000979 mol/l
Class : Moderately soluble
Log S (Ali) : -5.8
Solubility : 0.000334 mg/ml ; 0.00000157 mol/l
Class : Moderately soluble
Log S (SILICOS-IT) : -4.71
Solubility : 0.00418 mg/ml ; 0.0000197 mol/l
Class : Moderately soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 1.0 alert
Leadlikeness : 3.0
Synthetic accessibility : 2.04

Safety of [ 75853-49-5 ]

Signal Word:Warning Class:N/A
Precautionary Statements:P280-P305+P351+P338 UN#:N/A
Hazard Statements:H302-H315-H319-H335 Packing Group:N/A
GHS Pictogram:

Application In Synthesis of [ 75853-49-5 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

  • Downstream synthetic route of [ 75853-49-5 ]

[ 75853-49-5 ] Synthesis Path-Downstream   1~50

  • 2
  • [ 107841-97-4 ]
  • [ 75853-49-5 ]
YieldReaction ConditionsOperation in experiment
66.04% With periodic acid In tetrahydrofuran; diethyl ether for 4h;
  • 3
  • [ 7677-24-9 ]
  • [ 75853-49-5 ]
  • [ 671756-90-4 ]
YieldReaction ConditionsOperation in experiment
96% With triethylamine In dichloromethane at 25℃; for 2h;
  • 4
  • [ 5129-58-8 ]
  • [ 75853-49-5 ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 2 steps 1: 93 percent / LiAlH4 / diethyl ether / 2 h / 0 °C 2: 98 percent / pyridinium chlorochromate / CH2Cl2 / 24 h / 20 °C
  • 5
  • [ 75853-49-5 ]
  • [ 22226-24-0 ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 3 steps 1: 96 percent / Et3N / CH2Cl2 / 2 h / 25 °C 2: aq. HCl / 1,2-dimethoxy-ethane / 24 h / 90 °C 3: aq. NaOH / 1,2-dimethoxy-ethane / 2 h / 90 °C
  • 6
  • [ 75853-49-5 ]
  • 2-hydroxy-13-methyl-tetradecanoic acid amide [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 2 steps 1: 96 percent / Et3N / CH2Cl2 / 2 h / 25 °C 2: aq. HCl / 1,2-dimethoxy-ethane / 24 h / 90 °C
  • 7
  • [ 7766-50-9 ]
  • [ 75853-49-5 ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 3 steps 1: 1.) Mg, 2.) dilithium tetrachlorocuprate / 1) THF, 2.) THF, -10 deg C, 4 h 2: 1.) NaBH4, Hg(OAc)2, 2.) aq. H2O2, aq. NaOH / 1) THF, 16 h, room temperature; 2) THF, 70 deg C, 1 h 3: 84 percent / pyridinium chlorochromate / CH2Cl2 / 2 h
  • 8
  • [ 75853-49-5 ]
  • [ 90965-32-5 ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 2 steps 1: tetrahydrofuran 2: pyridinium chlorochromate / CH2Cl2
Multi-step reaction with 2 steps 1: 1) Mg / 1) ether, 2) ether, a) 0 deg C to rt, 4 h, b) overnight 2: 83.33 percent / pyridinium chlorochromate / CH2Cl2 / 3 h
  • 9
  • [ 156991-32-1 ]
  • [ 75853-49-5 ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 2 steps 1: 1.) NaBH4, Hg(OAc)2, 2.) aq. H2O2, aq. NaOH / 1) THF, 16 h, room temperature; 2) THF, 70 deg C, 1 h 2: 84 percent / pyridinium chlorochromate / CH2Cl2 / 2 h
  • 10
  • [ 88591-29-1 ]
  • [ 75853-49-5 ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 2 steps 1: 100 percent / LiAlH4 / tetrahydrofuran 2: pyridinium dichromate (PDC), molecular sieves 3A / CH2Cl2 / 2 h / Ambient temperature
  • 11
  • [ 157922-16-2 ]
  • [ 75853-49-5 ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 3 steps 1: 74 percent / H2 / 10percent Pd/C / ethanol / Ambient temperature 2: 100 percent / LiAlH4 / tetrahydrofuran 3: pyridinium dichromate (PDC), molecular sieves 3A / CH2Cl2 / 2 h / Ambient temperature
  • 12
  • [ 75853-49-5 ]
  • C35H58NOSSi(1+)*CF3O3S(1-) [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 3 steps 1: 2,2,5,7,8-pentamethylchroman-6-ol; (R,R)-1,2-bis(2,5-diphenylphospholanyl)ethane; mesitylcopper(I) / tetrahydrofuran; N,N-dimethyl-formamide / 40 h / -60 °C / Inert atmosphere 2: 2,6-dimethylpyridine / dichloromethane / 2 h / 0 °C 3: diethyl ether / 4.5 h / 0 - 20 °C
  • 13
  • [ 75853-49-5 ]
  • [ 1402050-29-6 ]
  • C32H50O2Si [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 4 steps 1: 2,2,5,7,8-pentamethylchroman-6-ol; (R,R)-1,2-bis(2,5-diphenylphospholanyl)ethane; mesitylcopper(I) / tetrahydrofuran; N,N-dimethyl-formamide / 40 h / -60 °C / Inert atmosphere 2: 2,6-dimethylpyridine / dichloromethane / 2 h / 0 °C 3: diethyl ether / 4.5 h / 0 - 20 °C 4: Li(1+)*AlH4(1-)*3C4H10O / tetrahydrofuran; dichloromethane / 4 h / -78 °C
  • 14
  • [ 75853-49-5 ]
  • [ 1402050-38-7 ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 5 steps 1: 2,2,5,7,8-pentamethylchroman-6-ol; (R,R)-1,2-bis(2,5-diphenylphospholanyl)ethane; mesitylcopper(I) / tetrahydrofuran; N,N-dimethyl-formamide / 40 h / -60 °C / Inert atmosphere 2: 2,6-dimethylpyridine / dichloromethane / 2 h / 0 °C 3: diethyl ether / 4.5 h / 0 - 20 °C 4: Li(1+)*AlH4(1-)*3C4H10O / tetrahydrofuran; dichloromethane / 4 h / -78 °C 5: tetrabutyl ammonium fluoride / tetrahydrofuran / 5 h / 0 - 20 °C
  • 15
  • [ 75853-49-5 ]
  • [ 1402050-28-5 ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 2 steps 1: 2,2,5,7,8-pentamethylchroman-6-ol; (R,R)-1,2-bis(2,5-diphenylphospholanyl)ethane; mesitylcopper(I) / tetrahydrofuran; N,N-dimethyl-formamide / 40 h / -60 °C / Inert atmosphere 2: 2,6-dimethylpyridine / dichloromethane / 2 h / 0 °C
  • 16
  • [ 1182707-33-0 ]
  • [ 75853-49-5 ]
  • [ 1402050-25-2 ]
  • C22H41NOS [ No CAS ]
YieldReaction ConditionsOperation in experiment
87 % ee With 2,2,5,7,8-pentamethylchroman-6-ol; mesitylcopper(I); (R,R)-1,2-bis(2,5-diphenylphospholanyl)ethane In tetrahydrofuran; N,N-dimethyl-formamide at -60℃; for 40h; Inert atmosphere; Overall yield = 92 %; Overall yield = 67.6 mg;
  • 17
  • [ 631-67-4 ]
  • [ 75853-49-5 ]
  • [ 1402050-26-3 ]
YieldReaction ConditionsOperation in experiment
69% With 2,2,5,7,8-pentamethylchroman-6-ol; mesitylcopper(I); (R,R)-1,2-bis(2,5-diphenylphospholanyl)ethane In tetrahydrofuran; N,N-dimethyl-formamide at -60℃; for 40h; Inert atmosphere;
  • 18
  • [ 112-47-0 ]
  • [ 75853-49-5 ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 3 steps 1: hydrogen bromide / water; toluene / 48 h / Reflux 2: dilithium tetrachlorocuprate / tetrahydrofuran / 20 h / -78 °C 3: oxalyl dichloride; dimethyl sulfoxide; triethylamine / dichloromethane / 4 h / -78 - 0 °C
  • 19
  • [ 53463-68-6 ]
  • [ 75853-49-5 ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 2 steps 1: dilithium tetrachlorocuprate / tetrahydrofuran / 20 h / -78 °C 2: oxalyl dichloride; dimethyl sulfoxide; triethylamine / dichloromethane / 4 h / -78 - 0 °C
  • 20
  • [ 75853-49-5 ]
  • C26H49NO4 [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 3 steps 1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C 3: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 15 h / 20 °C
  • 21
  • [ 75853-49-5 ]
  • C35H65N2O9P [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 4 steps 1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C 3: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 15 h / 20 °C 4: triethylamine; fluoro-N,N,N',N'-tetramethylformamidinium hexafluorophosphate; dmap / dichloromethane / 17 h / 20 °C
  • 22
  • [ 75853-49-5 ]
  • C35H65N2O11P [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 6 steps 1.1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2.1: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C 3.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 15 h / 20 °C 4.1: triethylamine; fluoro-N,N,N',N'-tetramethylformamidinium hexafluorophosphate; dmap / dichloromethane / 17 h / 20 °C 5.1: osmium(VIII) oxide; pyridine / 2.5 h / 20 °C 5.2: 20 h / 20 °C 6.1: 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione / ethyl acetate / 4 h / 75 °C
  • 23
  • [ 75853-49-5 ]
  • C40H78N3O12PSi [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 8 steps 1.1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2.1: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C 3.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 15 h / 20 °C 4.1: triethylamine; fluoro-N,N,N',N'-tetramethylformamidinium hexafluorophosphate; dmap / dichloromethane / 17 h / 20 °C 5.1: osmium(VIII) oxide; pyridine / 2.5 h / 20 °C 5.2: 20 h / 20 °C 6.1: 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione / ethyl acetate / 4 h / 75 °C 7.1: trifluoroacetic acid / dichloromethane / 3 h / 20 °C 8.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / dichloromethane / 21 h / 20 °C
  • 24
  • [ 75853-49-5 ]
  • C36H65N3O8Si [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 10 steps 1.1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2.1: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C 3.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 15 h / 20 °C 4.1: triethylamine; fluoro-N,N,N',N'-tetramethylformamidinium hexafluorophosphate; dmap / dichloromethane / 17 h / 20 °C 5.1: osmium(VIII) oxide; pyridine / 2.5 h / 20 °C 5.2: 20 h / 20 °C 6.1: 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione / ethyl acetate / 4 h / 75 °C 7.1: trifluoroacetic acid / dichloromethane / 3 h / 20 °C 8.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / dichloromethane / 21 h / 20 °C 9.1: Dess-Martin periodane / dichloromethane / 4 h / 20 °C 10.1: triethylamine; zinc trifluoromethanesulfonate; N,N,N,N,-tetramethylethylenediamine / tetrahydrofuran / 19 h / 20 °C
  • 25
  • [ 75853-49-5 ]
  • C30H51N3O8 [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 11 steps 1.1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2.1: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C 3.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 15 h / 20 °C 4.1: triethylamine; fluoro-N,N,N',N'-tetramethylformamidinium hexafluorophosphate; dmap / dichloromethane / 17 h / 20 °C 5.1: osmium(VIII) oxide; pyridine / 2.5 h / 20 °C 5.2: 20 h / 20 °C 6.1: 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione / ethyl acetate / 4 h / 75 °C 7.1: trifluoroacetic acid / dichloromethane / 3 h / 20 °C 8.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / dichloromethane / 21 h / 20 °C 9.1: Dess-Martin periodane / dichloromethane / 4 h / 20 °C 10.1: triethylamine; zinc trifluoromethanesulfonate; N,N,N,N,-tetramethylethylenediamine / tetrahydrofuran / 19 h / 20 °C 11.1: triethylamine tris(hydrogen fluoride) / tetrahydrofuran / 18 h / 20 °C
  • 26
  • [ 75853-49-5 ]
  • C31H53N3O10S [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 12 steps 1.1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2.1: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C 3.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 15 h / 20 °C 4.1: triethylamine; fluoro-N,N,N',N'-tetramethylformamidinium hexafluorophosphate; dmap / dichloromethane / 17 h / 20 °C 5.1: osmium(VIII) oxide; pyridine / 2.5 h / 20 °C 5.2: 20 h / 20 °C 6.1: 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione / ethyl acetate / 4 h / 75 °C 7.1: trifluoroacetic acid / dichloromethane / 3 h / 20 °C 8.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / dichloromethane / 21 h / 20 °C 9.1: Dess-Martin periodane / dichloromethane / 4 h / 20 °C 10.1: triethylamine; zinc trifluoromethanesulfonate; N,N,N,N,-tetramethylethylenediamine / tetrahydrofuran / 19 h / 20 °C 11.1: triethylamine tris(hydrogen fluoride) / tetrahydrofuran / 18 h / 20 °C 12.1: triethylamine / tetrahydrofuran / 1.17 h / 20 °C
  • 27
  • [ 75853-49-5 ]
  • C35H67N2O11P [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 5 steps 1.1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2.1: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C 3.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 15 h / 20 °C 4.1: triethylamine; fluoro-N,N,N',N'-tetramethylformamidinium hexafluorophosphate; dmap / dichloromethane / 17 h / 20 °C 5.1: osmium(VIII) oxide; pyridine / 2.5 h / 20 °C 5.2: 20 h / 20 °C
  • 28
  • [ 75853-49-5 ]
  • C31H57N2O11P [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 7 steps 1.1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2.1: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C 3.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 15 h / 20 °C 4.1: triethylamine; fluoro-N,N,N',N'-tetramethylformamidinium hexafluorophosphate; dmap / dichloromethane / 17 h / 20 °C 5.1: osmium(VIII) oxide; pyridine / 2.5 h / 20 °C 5.2: 20 h / 20 °C 6.1: 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione / ethyl acetate / 4 h / 75 °C 7.1: trifluoroacetic acid / dichloromethane / 3 h / 20 °C
  • 29
  • [ 75853-49-5 ]
  • C40H76N3O12PSi [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 9 steps 1.1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2.1: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C 3.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 15 h / 20 °C 4.1: triethylamine; fluoro-N,N,N',N'-tetramethylformamidinium hexafluorophosphate; dmap / dichloromethane / 17 h / 20 °C 5.1: osmium(VIII) oxide; pyridine / 2.5 h / 20 °C 5.2: 20 h / 20 °C 6.1: 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione / ethyl acetate / 4 h / 75 °C 7.1: trifluoroacetic acid / dichloromethane / 3 h / 20 °C 8.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / dichloromethane / 21 h / 20 °C 9.1: Dess-Martin periodane / dichloromethane / 4 h / 20 °C
  • 30
  • [ 75853-49-5 ]
  • C20H38O3 [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 2 steps 1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C
  • 31
  • [ 75853-49-5 ]
  • C26H49NO4 [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 3 steps 1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C 3: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 15 h / 20 °C
  • 32
  • [ 75853-49-5 ]
  • C35H65N2O9P [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 4 steps 1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C 3: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 15 h / 20 °C 4: triethylamine; fluoro-N,N,N',N'-tetramethylformamidinium hexafluorophosphate; dmap / dichloromethane / 17 h / 20 °C
  • 33
  • [ 75853-49-5 ]
  • C35H67N2O11P [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 5 steps 1.1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2.1: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C 3.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 15 h / 20 °C 4.1: triethylamine; fluoro-N,N,N',N'-tetramethylformamidinium hexafluorophosphate; dmap / dichloromethane / 17 h / 20 °C 5.1: osmium(VIII) oxide; pyridine / 2.5 h / 20 °C 5.2: 20 h / 20 °C
  • 34
  • [ 75853-49-5 ]
  • C35H65N2O11P [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 6 steps 1.1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2.1: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C 3.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 15 h / 20 °C 4.1: triethylamine; fluoro-N,N,N',N'-tetramethylformamidinium hexafluorophosphate; dmap / dichloromethane / 17 h / 20 °C 5.1: osmium(VIII) oxide; pyridine / 2.5 h / 20 °C 5.2: 20 h / 20 °C 6.1: 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione / ethyl acetate / 4 h / 75 °C
  • 35
  • [ 75853-49-5 ]
  • C31H57N2O11P [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 7 steps 1.1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2.1: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C 3.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 15 h / 20 °C 4.1: triethylamine; fluoro-N,N,N',N'-tetramethylformamidinium hexafluorophosphate; dmap / dichloromethane / 17 h / 20 °C 5.1: osmium(VIII) oxide; pyridine / 2.5 h / 20 °C 5.2: 20 h / 20 °C 6.1: 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione / ethyl acetate / 4 h / 75 °C 7.1: trifluoroacetic acid / dichloromethane / 3 h / 20 °C
  • 36
  • [ 75853-49-5 ]
  • C40H78N3O12PSi [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 8 steps 1.1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2.1: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C 3.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 15 h / 20 °C 4.1: triethylamine; fluoro-N,N,N',N'-tetramethylformamidinium hexafluorophosphate; dmap / dichloromethane / 17 h / 20 °C 5.1: osmium(VIII) oxide; pyridine / 2.5 h / 20 °C 5.2: 20 h / 20 °C 6.1: 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione / ethyl acetate / 4 h / 75 °C 7.1: trifluoroacetic acid / dichloromethane / 3 h / 20 °C 8.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / dichloromethane / 21 h / 20 °C
  • 37
  • [ 75853-49-5 ]
  • C40H76N3O12PSi [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 9 steps 1.1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2.1: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C 3.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 15 h / 20 °C 4.1: triethylamine; fluoro-N,N,N',N'-tetramethylformamidinium hexafluorophosphate; dmap / dichloromethane / 17 h / 20 °C 5.1: osmium(VIII) oxide; pyridine / 2.5 h / 20 °C 5.2: 20 h / 20 °C 6.1: 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione / ethyl acetate / 4 h / 75 °C 7.1: trifluoroacetic acid / dichloromethane / 3 h / 20 °C 8.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / dichloromethane / 21 h / 20 °C 9.1: Dess-Martin periodane / dichloromethane / 4 h / 20 °C
  • 38
  • [ 75853-49-5 ]
  • C36H65N3O8Si [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 10 steps 1.1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2.1: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C 3.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 15 h / 20 °C 4.1: triethylamine; fluoro-N,N,N',N'-tetramethylformamidinium hexafluorophosphate; dmap / dichloromethane / 17 h / 20 °C 5.1: osmium(VIII) oxide; pyridine / 2.5 h / 20 °C 5.2: 20 h / 20 °C 6.1: 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione / ethyl acetate / 4 h / 75 °C 7.1: trifluoroacetic acid / dichloromethane / 3 h / 20 °C 8.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / dichloromethane / 21 h / 20 °C 9.1: Dess-Martin periodane / dichloromethane / 4 h / 20 °C 10.1: triethylamine; zinc trifluoromethanesulfonate; N,N,N,N,-tetramethylethylenediamine / tetrahydrofuran / 19 h / 20 °C
  • 39
  • [ 75853-49-5 ]
  • C30H51N3O8 [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 11 steps 1.1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2.1: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C 3.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 15 h / 20 °C 4.1: triethylamine; fluoro-N,N,N',N'-tetramethylformamidinium hexafluorophosphate; dmap / dichloromethane / 17 h / 20 °C 5.1: osmium(VIII) oxide; pyridine / 2.5 h / 20 °C 5.2: 20 h / 20 °C 6.1: 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione / ethyl acetate / 4 h / 75 °C 7.1: trifluoroacetic acid / dichloromethane / 3 h / 20 °C 8.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / dichloromethane / 21 h / 20 °C 9.1: Dess-Martin periodane / dichloromethane / 4 h / 20 °C 10.1: triethylamine; zinc trifluoromethanesulfonate; N,N,N,N,-tetramethylethylenediamine / tetrahydrofuran / 19 h / 20 °C 11.1: triethylamine tris(hydrogen fluoride) / tetrahydrofuran / 18 h / 20 °C
  • 40
  • [ 75853-49-5 ]
  • C31H53N3O10S [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 12 steps 1.1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2.1: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C 3.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / N,N-dimethyl-formamide / 15 h / 20 °C 4.1: triethylamine; fluoro-N,N,N',N'-tetramethylformamidinium hexafluorophosphate; dmap / dichloromethane / 17 h / 20 °C 5.1: osmium(VIII) oxide; pyridine / 2.5 h / 20 °C 5.2: 20 h / 20 °C 6.1: 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione / ethyl acetate / 4 h / 75 °C 7.1: trifluoroacetic acid / dichloromethane / 3 h / 20 °C 8.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; 1-hydroxy-7-aza-benzotriazole; N-ethyl-N,N-diisopropylamine / dichloromethane / 21 h / 20 °C 9.1: Dess-Martin periodane / dichloromethane / 4 h / 20 °C 10.1: triethylamine; zinc trifluoromethanesulfonate; N,N,N,N,-tetramethylethylenediamine / tetrahydrofuran / 19 h / 20 °C 11.1: triethylamine tris(hydrogen fluoride) / tetrahydrofuran / 18 h / 20 °C 12.1: triethylamine / tetrahydrofuran / 1.17 h / 20 °C
  • 41
  • [ 75853-49-5 ]
  • C20H38O3 [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 2 steps 1: titanium tetrachloride / dichloromethane / 42 h / -78 °C 2: lithium hydroxide; dihydrogen peroxide / water; tetrahydrofuran / 19 h / 20 °C
  • 42
  • C18H33NO3Si [ No CAS ]
  • [ 75853-49-5 ]
  • C26H47NO4 [ No CAS ]
  • C26H47NO4 [ No CAS ]
YieldReaction ConditionsOperation in experiment
87% With titanium tetrachloride In dichloromethane at -78℃; for 42h;
  • 43
  • [ 107841-96-3 ]
  • [ 75853-49-5 ]
YieldReaction ConditionsOperation in experiment
93.5% With ozone In dichloromethane at -55℃; 2.4 Step four dilute ozonation Dichloromethane (331 ml) and D (41.4 g) were successively added to the reaction vessel, and the temperature was lowered to -55°C. Under vigorous stirring, ozone was introduced into the reaction vessel. After the GC reaction was completed, ozone was stopped and ozone was slowly added dropwise. Ethyl ether, without drastic increase in temperature after dropping, the system temperature 10 ~ 30 ° C, adding water 82ml, liquid separation, dichloromethane phase was dried over anhydrous sodium sulfate, and concentrated to give a liquid product TM 38.9g, gas phase mass spectrometry purity 99.0% , Yield 93.5%.
  • 44
  • [ 2724-57-4 ]
  • [ 75853-49-5 ]
YieldReaction ConditionsOperation in experiment
With recombinant carboxylic acid reductase from Mycobacterium marinum; ATP; NADPH; magnesium chloride In aq. phosphate buffer; hexane at 30℃; for 8h; Enzymatic reaction;
  • 45
  • [ 75853-49-5 ]
  • ethyl 14-methylpentadec-2-ynoate [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 2 steps 1.1: triphenylphosphine / dichloromethane / 0.5 h / -10 - -5 °C 1.2: 3 h / -10 - -5 °C 2.1: n-butyllithium / tetrahydrofuran / 2 h / -78 - 0 °C 2.2: 1.5 h / -78 - 20 °C
  • 46
  • [ 75853-49-5 ]
  • 14-methyl-2-pentadecynylic acid [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 3 steps 1.1: triphenylphosphine / dichloromethane / 0.5 h / -10 - -5 °C 1.2: 3 h / -10 - -5 °C 2.1: n-butyllithium / tetrahydrofuran / 2 h / -78 - 0 °C 2.2: 1.5 h / -78 - 20 °C 3.1: sodium hydroxide / <i>tert</i>-butyl alcohol; water / 6 h / 60 °C
  • 47
  • [ 75853-49-5 ]
  • (Z)-14-methylpentadec-2-enoic acid [ No CAS ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 4 steps 1.1: triphenylphosphine / dichloromethane / 0.5 h / -10 - -5 °C 1.2: 3 h / -10 - -5 °C 2.1: n-butyllithium / tetrahydrofuran / 2 h / -78 - 0 °C 2.2: 1.5 h / -78 - 20 °C 3.1: sodium hydroxide / <i>tert</i>-butyl alcohol; water / 6 h / 60 °C 4.1: hydrogen; quinoline / ethanol / 24 h / 760.05 Torr
  • 48
  • [ 558-13-4 ]
  • [ 75853-49-5 ]
  • 1,1-dibromo-13-methyltetradec-1-ene [ No CAS ]
YieldReaction ConditionsOperation in experiment
94 mg Stage #1: carbon tetrabromide With triphenylphosphine In dichloromethane at -10 - -5℃; for 0.5h; Stage #2: 12-methyltridecan-1-al In dichloromethane at -10 - -5℃; for 3h;
  • 49
  • C21H34O [ No CAS ]
  • [ 75853-49-5 ]
YieldReaction ConditionsOperation in experiment
Multi-step reaction with 2 steps 1: palladium on activated carbon; hydrogen / methanol / 3 h / 20 °C 2: Dess-Martin periodane / dichloromethane / 1 h / 20 °C
  • 50
  • [ 2485-71-4 ]
  • [ 75853-49-5 ]
YieldReaction ConditionsOperation in experiment
With α‑dioxygenase from Crocosphaera subtropica In aq. phosphate buffer Enzymatic reaction;
Recommend Products
Same Skeleton Products

Technical Information

• 1,4-Addition of an Amine to a Conjugated Enone • 1,4-Addition of an Amine to a Conjugated Enone • 1,4-Additions of Organometallic Reagents • Acetal Formation • Add Hydrogen Cyanide to Aldehydes and Ketones to Produce Alcohols • Alcohol Syntheses from Aldehydes, Ketones and Organometallics • Aldehydes and Ketones Form Hemiacetals Reversibly • Aldehydes May Made by Terminal Alkynes Though Hydroboration-oxidation • Aldol Addition • Aldol Condensation • Alkenes React with Ozone to Produce Carbonyl Compounds • Alkylation of Aldehydes or Ketones • Amides Can Be Converted into Aldehydes • Barbier Coupling Reaction • Baylis-Hillman Reaction • Bucherer-Bergs Reaction • Clemmensen Reduction • Complex Metal Hydride Reductions • Conjugated Enone Takes Part in 1,4-Additions • Convert Aldonic Acid into the Lower Aldose by Oxidative Decarboxylation • Convert Esters into Aldehydes Using a Milder Reducing Agent • Corey-Chaykovsky Reaction • Corey-Fuchs Reaction • Cyanohydrins can be Convert to Carbonyl Compounds under Basic Conditions • Deoxygenation of the Carbonyl Group • Deprotonation of a Carbonyl Compound at the α -Carbon • DIBAL Attack Nitriles to Give Ketones • Dithioacetal Formation • Enamine Formation • Enamines Can Be Used to Prepare Alkylated Aldehydes • Enol-Keto Equilibration • Exclusive 1,4-Addition of a Lithium Organocuprate • Fischer Indole Synthesis • Grignard Reaction • Hantzsch Dihydropyridine Synthesis • Heat of Combustion • Hemiaminal Formation from Amines and Aldehydes or Ketones • Hemiaminal Formation from Amines and Aldehydes or Ketones • Henry Nitroaldol Reaction • HIO4 Oxidatively Degrades Vicinal Diols to Give Carbonyl Derivatives • Horner-Wadsworth-Emmons Reaction • Hydration of the Carbonyl Group • Hydride Reductions • Hydride Reductions of Aldehydes and Ketones to Alcohols • Hydride Reductions of Aldehydes and Ketones to Alcohols • Hydroboration of a Terminal Alkyne • Hydrogenation by Palladium on Carbon Gives the Saturated Carbonyl Compound • Hydrolysis of Imines to Aldehydes and Ketones • Imine Formation from Amines and Aldehydes or Ketones • Julia-Kocienski Olefination • Knoevenagel Condensation • Leuckart-Wallach Reaction • Lithium Organocuprate may Add to the α ,β -Unsaturated Carbonyl Function in 1,4-Fashion • McMurry Coupling • Meerwein-Ponndorf-Verley Reduction • Mukaiyama Aldol Reaction • Nozaki-Hiyama-Kishi Reaction • Oxidation of Alcohols to Carbonyl Compounds • Oxidation of Aldehydes Furnishes Carboxylic Acids • Passerini Reaction • Paternò-Büchi Reaction • Periodic Acid Degradation of Sugars • Petasis Reaction • Phenylhydrazone and Phenylosazone Formation • Pictet-Spengler Tetrahydroisoquinoline Synthesis • Preparation of Aldehydes and Ketones • Preparation of Amines • Prins Reaction • Pyrroles, Furans, and Thiophenes are Prepared from γ-Dicarbonyl Compounds • Reactions of Aldehydes and Ketones • Reactions of Amines • Reduction of an Ester to an Aldehyde • Reductive Amination • Reformatsky Reaction • Schlosser Modification of the Wittig Reaction • Schmidt Reaction • Selective Eduction of Acyl Chlorides to Produce Aldehydes • Stetter Reaction • Stobbe Condensation • Strecker Synthesis • Synthesis of 2-Amino Nitriles • Tebbe Olefination • The Cycloaddition of Dienes to Alkenes Gives Cyclohexenes • The Wittig Reaction • Thiazolium Salt Catalysis in Aldehyde Coupling • Thiazolium Salts Catalyze Aldehyde Coupling • Thiazolium Salts Catalyze Aldehyde Coupling • Ugi Reaction • Use 1,3-dithiane to Prepare of α-Hydroxyketones • Wittig Reaction • Wolff-Kishner Reduction
Historical Records

Related Functional Groups of
[ 75853-49-5 ]

Aliphatic Chain Hydrocarbons

Chemical Structure| 5435-64-3

[ 5435-64-3 ]

3,5,5-Trimethylhexanal

Similarity: 0.92

Chemical Structure| 7786-29-0

[ 7786-29-0 ]

2-Methyloctanal

Similarity: 0.92

Chemical Structure| 26254-92-2

[ 26254-92-2 ]

2-Ethyl-3-methylbutanal

Similarity: 0.92

Chemical Structure| 7492-38-8

[ 7492-38-8 ]

2-Methyloctan-4-one

Similarity: 0.86

Chemical Structure| 928-68-7

[ 928-68-7 ]

6-Methylheptan-2-one

Similarity: 0.86

Aldehydes

Chemical Structure| 5435-64-3

[ 5435-64-3 ]

3,5,5-Trimethylhexanal

Similarity: 0.92

Chemical Structure| 6540-31-4

[ 6540-31-4 ]

2-Cyclobutylacetaldehyde

Similarity: 0.92

Chemical Structure| 4361-28-8

[ 4361-28-8 ]

3-Cyclohexylpropanal

Similarity: 0.92

Chemical Structure| 26254-92-2

[ 26254-92-2 ]

2-Ethyl-3-methylbutanal

Similarity: 0.92

Chemical Structure| 4277-29-6

[ 4277-29-6 ]

Cycloheptanecarbaldehyde

Similarity: 0.92

; ;