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Chemical Structure| 24964-76-9 Chemical Structure| 24964-76-9

Structure of 24964-76-9

Chemical Structure| 24964-76-9

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Product Details of [ 24964-76-9 ]

CAS No. :24964-76-9
Formula : C10H22O3
M.W : 190.28
SMILES Code : CCCC(OCC)(OCC)OCC
MDL No. :MFCD00059382
InChI Key :KOPMZTKUZCNGFY-UHFFFAOYSA-N
Pubchem ID :371779

Safety of [ 24964-76-9 ]

GHS Pictogram:
Signal Word:Danger
Hazard Statements:H225-H315-H319
Precautionary Statements:P305+P351+P338
Class:3
UN#:1993
Packing Group:

Application In Synthesis of [ 24964-76-9 ]

* 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 [ 24964-76-9 ]

[ 24964-76-9 ] Synthesis Path-Downstream   1~4

  • 1
  • methyl 4'-aminomethylbiphenyl-2-carboxylate hydrochloride [ No CAS ]
  • [ 24964-76-9 ]
  • [ 20605-41-8 ]
  • [ 124806-70-8 ]
YieldReaction ConditionsOperation in experiment
With 1,8-diazabicyclo[5.4.0]undec-7-ene; Part A: 3-Methoxymethyl-5-propyl-4-[(2'-carbomethoxy-biphenyl-4-yl)methyl]-1.2.4-triazole This compound was prepared according to the method described for Example 67, Part B. From triethyl orthobutyrate (3.1 g, 16.2 mmol) methoxyacetyl hydrazide (1.7 g, 16.2 mmol) DBU (1.8 ml, 11.9 mmol) and methyl 4'-aminomethylbiphenyl-2-carboxylate hydrochloride (3.0 g, 10.8 mmol) in refluxing xylenes (50 ml) was obtained 2.3 g (56percent) of the title compound as a colorless oil following flash chromatography. NMR (200 MHz;CDCl3, TMS) delta: 7.88-7.04 (m,8H), 5.25 (s,2H), 4.56 (s,2H), 3.65 (s,3H), 3.34 (s,3H), 2.66 (t,J=7 Hz,2H), 1.78 (m,2H), 0.98 (t,J=7 Hz,3H).
With 1,8-diazabicyclo[5.4.0]undec-7-ene; Part A 3-Methoxymethyl-5-propyl-4-[(2'-carbomethoxybiphenyl-4-yl)methyl]-1,2,4-triazole This compound was prepared according to the method described for Example 67, Part B. From triethyl orthobutyrate (3.1 g, 16.2 mmol) methoxyacetyl hydrazide (1.7 g, 16.2 mmol) DBU (1.8 ml, 11.9 mmol) and methyl 4'-aminomethylbiphenyl-2-carboxylate hydrochloride (3.0 g, 10.8 mmol) in refluxing xylenes (50 ml) was obtained 2.3 g (56percent) of the title compound as a colorless oil following flash chromatography. NMR (200 MHz;CDCl3,TMS)delta: 7.88-7.04(m,8H), 5.25(s,2H), 4.56(s,2H), 3.65(s,3H), 3.34(s,3H), 2.66(t,J=7 Hz,2H), 1.78(m,2H), 0.98(t,J=7 Hz,3H).
  • 2
  • 4'-aminomethylbiphenyl-2-nitrile [ No CAS ]
  • [ 24964-76-9 ]
  • [ 20605-41-8 ]
  • [ 124806-73-1 ]
YieldReaction ConditionsOperation in experiment
With 1,8-diazabicyclo[5.4.0]undec-7-ene; Part A 3-Methoxymethyl-5-propyl-4-[(2'-cyanobiphenyl-4-yl)methyl]-1,2,4-triazole This compound was prepared according to the methods described for Example 67, Part B. From triethyl orthobutyrate (2.3 g, 12.3 mmol) methoxyacetyl hydrazide (1.4 g, 12.3 mmol), DBU (1.4 ml, 8.9 mmol) and 4'-aminomethylbiphenyl-2-nitrile (2.0 g, 8.2 mmol) in refluxing xylenes (50 ml) was obtained 1.6 g (57percent) of the title compound, as a viscous oil which slowly crystallized upon standing at room temperature. NMR (200 MHz;CDCl3,TMS)delta: 7.80-7.12(m,8H), 5.28(s,2H), 4.56(s,2H), 3.34(s,3H), 2.65(t,J=7 Hz,2H), 1.78(m,2H), 0.99(t,J=7 Hz,3H).
  • 3
  • [ 37901-95-4 ]
  • [ 24964-76-9 ]
  • [ 152628-03-0 ]
YieldReaction ConditionsOperation in experiment
94.4% With methanesulfonic acid; In N,N-dimethyl-formamide; at 70℃; for 9h; 5 g of compound 12 was added to 30 mL of DMF, 4.1 g of triethyl orthobutyrate and 0.5 g of methanesulfonic acid were added, and the mixture was heated with stirringTo 70 , the reaction 9h. The reaction was monitored by HPLC to control the remaining amount of raw materials to be 0.5% or less of the initial amount. Ice bath cooling crystallization 2h, vacuum suction filtration. The wet product was dried at 80 C to give 6.2 g of white solid compound 2 as a white solid, yield 94.4%.
  • 4
  • [ 24964-76-9 ]
  • [ 5900-59-4 ]
  • 7-chloro-2-propylquinazolin-4(3H)-one [ No CAS ]
YieldReaction ConditionsOperation in experiment
89% With acetic acid; In ethanol; at 110℃; for 24h;Inert atmosphere; Sealed tube; General procedure: The 2-aminobenzamide (1 equiv), the orthoester (2?3 equiv) and absolute ethanol (2?3 mL) wereplaced in a 15-mL Chemglass screw-cap pressure tube (No. CG-1880-01, Chemglass, Vineland, NJ,USA). Glacial acetic acid (3 equiv) was added, N2 was introduced to the vessel and the cap wastightened. The vessel was heated at 110 °C for 12?72 h, then cooled and concentrated to give thequinazolinone, which was purified by crystallization from absolute ethanol or trituration from 5percentether in pentane. The following compounds were prepared:
 

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