[ CAS No. 563-63-3 ] {[proInfo.proName]}

Name: 563-63-3|Silver(I) acetate|98%
Brand: Ambeed
SKU: A740334
Price: 5.0 USD
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Quality Control of [ 563-63-3 ]

COA NMR CNMR HPLC LC-MS

Related Doc. of [ 563-63-3 ]

SDS Specification

Alternatived Products of [ 563-63-3 ]

Product Details of [ 563-63-3 ]

CAS No. :	563-63-3	MDL No. :	MFCD00012446
Formula :	C₂H₃AgO₂	Boiling Point :	-
Linear Structure Formula :	-	InChI Key :	CQLFBEKRDQMJLZ-UHFFFAOYSA-M
M.W :	166.91	Pubchem ID :	11246
Synonyms :

Calculated chemistry of [ 563-63-3 ]

Physicochemical Properties

Num. heavy atoms :	5
Num. arom. heavy atoms :	0
Fraction Csp3 :	0.5
Num. rotatable bonds :	0
Num. H-bond acceptors :	2.0
Num. H-bond donors :	0.0
Molar Refractivity :	11.56
TPSA :	40.13 Å²

Pharmacokinetics

GI absorption :	Low
BBB permeant :	No
P-gp substrate :	No
CYP1A2 inhibitor :	No
CYP2C19 inhibitor :	No
CYP2C9 inhibitor :	No
CYP2D6 inhibitor :	No
CYP3A4 inhibitor :	No
Log Kp (skin permeation) :	-7.47 cm/s

Lipophilicity

Log Po/w (iLOGP) :	0.0
Log Po/w (XLOGP3) :	-0.21
Log Po/w (WLOGP) :	-1.24
Log Po/w (MLOGP) :	-0.49
Log Po/w (SILICOS-IT) :	-0.48
Consensus Log Po/w :	-0.48

Druglikeness

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

Water Solubility

Log S (ESOL) :	-0.74
Solubility :	30.2 mg/ml ; 0.181 mol/l
Class :	Very soluble
Log S (Ali) :	-0.18
Solubility :	111.0 mg/ml ; 0.667 mol/l
Class :	Very soluble
Log S (SILICOS-IT) :	0.53
Solubility :	571.0 mg/ml ; 3.42 mol/l
Class :	Soluble

Medicinal Chemistry

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

Safety of [ 563-63-3 ]

Signal Word:	Danger	Class:	9
Precautionary Statements:	P501-P273-P260-P270-P264-P280-P391-P314-P337+P313-P305+P351+P338-P301+P312+P330	UN#:	3077
Hazard Statements:	H302-H319-H372-H410	Packing Group:	Ⅲ
GHS Pictogram:

Application In Synthesis of [ 563-63-3 ]

* 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.

Upstream synthesis route of [ 563-63-3 ]
Downstream synthetic route of [ 563-63-3 ]

[ 563-63-3 ] Synthesis Path-Upstream 1~11

1
[ 563-63-3 ]
[ 372077-73-1 ]
[ 114306-17-1 ]

Reference： [1] RSC Advances, 2018, vol. 8, # 27, p. 14747 - 14752

2
[ 3508-00-7 ]
[ 563-63-3 ]
[ 1454-85-9 ]

Reference： [1] Bulletin of the Chemical Society of Japan, 1959, vol. 32, p. 1295,1297

3
[ 17533-18-5 ]
[ 563-63-3 ]
[ 64-19-7 ]
[ 573-17-1 ]

Reference： [1] Chemische Berichte, 1878, vol. 11, p. 1219

4
[ 51104-94-0 ]
[ 563-63-3 ]
[ 64-19-7 ]
[ 853-23-6 ]

Reference： [1] Chemische Berichte, 1942, vol. 75, p. 597,603

5
[ 563-63-3 ]
[ 22115-41-9 ]
[ 38866-59-0 ]

Reference： [1] Bulletin de l'Academie Polonaise des Sciences, Serie des Sciences Chimiques, 1972, vol. 20, p. 411 - 415

6
[ 618-91-7 ]
[ 563-63-3 ]
[ 127-09-3 ]
[ 52787-19-6 ]

Yield	Reaction Conditions	Operation in experiment
42%	for 24 h; Reflux	General procedure: Iodo methyl benzoate (0.5 g, 1.90 mmol), silver acetate (0.47 g, 2.85 mmol), sodium acetate (0.77g,9.50 mmol) and PdCl2 (34 mg, 0.19 mmol) were dissolved in AcOH (5 mL). Reaction mixture wasrefluxed for 24 h. The mixture was poured in the saturated NH4Cl and extracted with AcOEt. Theorganic phase was washed with water, dried over Na2SO4, filtered and concentrated under reducedpressure. The crude residue was purified with flash chromatography on silica gel, eluting with 50percentAcOEt/Hex to give pure compound.

Reference： [1] Bioorganic and Medicinal Chemistry Letters, 2018, vol. 28, # 4, p. 637 - 641

7
[ 563-63-3 ]
[ 2923-28-6 ]

Reference： [1] Journal of Organometallic Chemistry, 2000, vol. 600, # 1-2, p. 112 - 117

8
[ 563-63-3 ]
[ 21259-75-6 ]
[ 811-68-7 ]

Reference： [1] Journal of the Chemical Society, [2] Journal of the Chemical Society, 1962, p. 1254 - 1260
[3] , Gmelin Handbook: F: PerFHalOrg.2, 1.1.6.11, page 32 - 49,

9
[ 563-63-3 ]
[ 21259-75-6 ]
[ 811-68-7 ]

Reference： [1] Journal of the Chemical Society, [2] Journal of the Chemical Society, 1962, p. 1254 - 1260
[3] , Gmelin Handbook: F: PerFHalOrg.2, 1.1.6.11, page 32 - 49,

10
[ 563-63-3 ]
[ 65039-08-9 ]
[ 143314-17-4 ]

Reference： [1] Chemical Communications, 2017, vol. 53, # 81, p. 11154 - 11156
[2] Physical Chemistry Chemical Physics, 2013, vol. 15, # 47, p. 20480 - 20495
[3] Carbohydrate Polymers, 2015, vol. 121, p. 348 - 354

11
[ 563-63-3 ]
[ 65039-09-0 ]
[ 143314-17-4 ]

Reference： [1] Green Chemistry, 2012, vol. 14, # 10, p. 2738 - 2746,9
[2] Green Chemistry, 2012, vol. 14, # 10, p. 2738 - 2746

[ 563-63-3 ] Synthesis Path-Downstream 1~88

1
[ 26340-47-6 ]
[ 563-63-3 ]
[ 608-08-2 ]

Yield	Reaction Conditions	Operation in experiment
41%	With acetic acid; at 90℃; for 1h;	Into a 500 mL round bottom flask was placed a solution of 3-iodo-lH-indole (23 g, 94.65 mmol) in acetic acid (300 mL). To the mixture was added CH3COOAg (31.6 g, 189.22 mmol). The resulting solution was allowed to react, with stirring, for 1 hour while the temperature was maintained at 90 C in a bath of oil. The reaction progress was monitored by TLC (ethyl acetate/petroleum ether = 1:1). A filtration was performed. The filtrate was concentrated by evaporation under vacuum using a rotary evaporator. The resulting solution was dissolved with 100 mL of ethyl acetate. The resulting mixture was washed 2 times with 100 mL of NaCl(aq.). The final product was purified by recrystallization from MeOHTH2O in the ratio 2:3. This resulted in 8.5 g (41%) of lH-indol-3-yl acetate as a dark purple solid.

Reference： [1]Patent: WO2007/98418,2007,A1 .Location in patent: Page/Page column 112
[2]Journal of Organic Chemistry,1959,vol. 24,p. 117

2
[ 629-09-4 ]
[ 563-63-3 ]
[ 6222-17-9 ]

Yield	Reaction Conditions	Operation in experiment
	With acetic acid

Reference： [1]Hamonet [Bulletin de la Societe Chimique de France, 1905, vol. <3>33, p. 530][Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, 1904, vol. 138, p. 1611]

3
[ 75-11-6 ]
[ 563-63-3 ]
[ 628-51-3 ]

Reference： [1]Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences,1858,vol. 46,p. 596
Justus Liebigs Annalen der Chemie,1858,vol. 107,p. 111

4
[ 2216-35-5 ]
[ 563-63-3 ]
[ 14936-66-4 ]

Yield	Reaction Conditions	Operation in experiment
	With diethyl ether acetate of inactive methyl-n-heptyl-carbinol;

Reference： [1]van Gysegem [Chemisches Zentralblatt, 1907, vol. 78, # I, p. 530]

5
[ 3508-00-7 ]
[ 563-63-3 ]
[ 1454-85-9 ]

Reference： [1]Bulletin of the Chemical Society of Japan,1959,vol. 32,p. 1295,1297

6
[ 28148-04-1 ]
[ 563-63-3 ]
[ 55289-53-7 ]

Reference： [1]Journal of the American Chemical Society,1951,vol. 73,p. 366,368

7
[ 4276-50-0 ]
[ 563-63-3 ]
[ 15594-90-8 ]

Reference： [1]Bulletin of the Chemical Society of Japan,1959,vol. 32,p. 1295,1297

8
[ 563-63-3 ]
[ 142-28-9 ]
[ 628-09-1 ]

Reference： [1]Anales de la Real Sociedad Espanola de Fisica y Quimica,vol. 27,p. 799
Chemisches Zentralblatt,1930,vol. 101,p. 2382

9
[ 25570-96-1 ]
[ 563-63-3 ]
[ 64-19-7 ]
[ 565-48-0 ]
[ 98-55-5 ]
[ 80-53-5 ]

Reference： [1]Justus Liebigs Annalen der Chemie,1906,vol. 350,p. 155
Justus Liebigs Annalen der Chemie,1907,vol. 356,p. 216

10
[ 62235-61-4 ]
[ 563-63-3 ]
3-(acetyloxymethyl)-2(1H)-quinoxalinone [ No CAS ]

Reference： [1]Bulletin of the Chemical Society of Japan,1983,vol. 56,p. 326 - 330

11
[ 7598-10-9 ]
[ 563-63-3 ]
[ 17241-72-4 ]

Reference： [1]Journal of Organic Chemistry,1987,vol. 52,p. 2059 - 2064

12
[ 563-63-3 ]
[ 21987-33-7 ]
[ 95931-57-0 ]
[ 95931-56-9 ]
[ 89678-08-0 ]

Reference： [1]Tetrahedron,1984,vol. 40,p. 5063 - 5070

13
[ 13209-15-9 ]
[ 563-63-3 ]
[ 6500-54-5 ]

Reference： [1]Journal of the Chemical Society C: Organic,1966,p. 990 - 994

14
[ 563-63-3 ]
[ 22115-41-9 ]
[ 38866-59-0 ]

Reference： [1]Bulletin de l'Academie Polonaise des Sciences, Serie des Sciences Chimiques,1972,vol. 20,p. 411 - 415

15
[ 51175-79-2 ]
[ 563-63-3 ]
[ 51175-75-8 ]

Reference： [1]Journal of Organic Chemistry,1974,vol. 39,p. 1761 - 1763

16
[ 40774-41-2 ]
[ 563-63-3 ]
[ 30385-41-2 ]

Reference： [1]Acta chemica Scandinavica. Series B: Organic chemistry and biochemistry,1975,vol. 29,p. 503 - 506

17
[ 7203-96-5 ]
[ 563-63-3 ]
[ 105-60-2 ]
[ 1888-91-1 ]

Reference： [1]Tetrahedron,1997,vol. 53,p. 14463 - 14480

18
[ 563-63-3 ]
[ 108-24-7 ]
[ 4016-63-1 ]
Acetic acid 2-acetylamino-9-((2R,3R,4R,5R)-3,4-diacetoxy-5-acetoxymethyl-tetrahydro-furan-2-yl)-6-oxo-6,9-dihydro-1H-purin-8-yl ester [ No CAS ]

Reference： [1]Journal of labelled compounds and radiopharmaceuticals,2003,vol. 46,p. 815 - 835

19
[ 3114-70-3 ]
[ 7732-18-5 ]
[ 563-63-3 ]
Ag⁽¹⁺⁾*CH₃COO^(1-)*H₂NC₆H₁₀NH₂*4H₂O=Ag[H₂NC₆H₁₀NH₂][CH₃COO]*4H₂O [ No CAS ]

Reference： [1]Chemical Communications,2005,p. 2915 - 2917

20
[ 3114-70-3 ]
[ 7732-18-5 ]
[ 563-63-3 ]
Ag⁽¹⁺⁾*CH₃COO^(1-)*H₂NC₆H₁₀NH₂*99H₂O=Ag[H₂NC₆H₁₀NH₂][CH₃COO]*99H₂O [ No CAS ]

Reference： [1]Chemical Communications,2005,p. 2915 - 2917

21
[ 24415-66-5 ]
[ 563-63-3 ]
[ 3428-02-2 ]

Reference： [1]Zhurnal Obshchei Khimii,1964,vol. 34,p. 504 - 509
Zhurnal Obshchei Khimii,1964,vol. 34,p. 502 - 508

22
tetrafluoroboric acid [ No CAS ]
[ 563-63-3 ]
[ 10025-83-9 ]
{Ir₃O(O₂CCH₃)6(H₂O)3}⁽¹⁺⁾*BF₄^(1-)*4H₂O={Ir₃O(O₂CCH₃)6(H₂O)3}BF₄*4H₂O [ No CAS ]

Reference： [1]Inorganica Chimica Acta,1993,vol. 213,p. 99 - 102

23
[ 563-63-3 ]
[ 10025-83-9 ]
{Ir₃O(O₂CCH₃)6(H₂O)3}⁽²⁺⁾*1.667ClO₃^(1-)*0.333ClO₄^(1-)={Ir₃O(O₂CCH₃)6(H₂O)3}(ClO₃)1.667(Cl⁽⁰³⁾O₄)33 [ No CAS ]

Reference： [1]Inorganica Chimica Acta,1993,vol. 213,p. 99 - 102

24
[ 563-63-3 ]
[ 84494-89-3 ]
[ 96453-04-2 ]

Reference： [1]Organometallics,1985,vol. 4,p. 1208 - 1213

25
[ 27721-02-4 ]
[ 563-63-3 ]
[Ag(acetate)(1,5-bis(diphenylphosphino)pentane](.infin.) [ No CAS ]

Reference： [1]Inorganica Chimica Acta,2005,vol. 358,p. 763 - 795

26
[ 1450-85-7 ]
[PtI(Me)3(2,2'-bipyridyl)] [ No CAS ]
[ 563-63-3 ]
[ 913544-01-1 ]

Reference： [1]Inorganica Chimica Acta,2006,vol. 359,p. 4326 - 4334

27
[ 1450-85-7 ]
(trimethylplatinum(IV) iodide)4 [ No CAS ]
[ 563-63-3 ]
[ 913544-05-5 ]

Reference： [1]Inorganica Chimica Acta,2006,vol. 359,p. 4326 - 4334

28
[ 4099-46-1 ]
[ 563-63-3 ]
[ 607-01-2 ]
[ 935681-91-7 ]

Reference： [1]Inorganic Chemistry,2007,vol. 46,p. 2478 - 2484

29
[ 3385-94-2 ]
[ 563-63-3 ]
[ 607-01-2 ]
[ 935681-89-3 ]

Reference： [1]Inorganic Chemistry,2007,vol. 46,p. 2478 - 2484

30
[ 88-82-4 ]
[ 563-63-3 ]
[ 271790-47-7 ]

Reference： [1]Inorganic Chemistry,2000,vol. 39,p. 2146 - 2151

31
[ 75-09-2 ]
[ 76186-04-4 ]
[ 563-63-3 ]
[Ag₂((S)-4-isopropylthiazolidine-2-thionate)2]3 [ No CAS ]

Reference： [1]European Journal of Inorganic Chemistry,2002,p. 3264 - 3267

32
[ 563-63-3 ]
[ 564483-18-7 ]
[ 1109286-86-3 ]

Reference： [1]Organometallics,2009,vol. 28,p. 795 - 801

33
[ 100-97-0 ]
[ 563-63-3 ]
[ 5625-37-6 ]
2Ag⁽¹⁺⁾*(CH₂)4N₂(CH₂CH₂SO₃)2^(2-)*2N₄(CH₂)6*14H₂O=[Ag₂(C₈H₁₆N₂O₆S₂)(C₆H₁₂N₄)2(H₂O)2]*12H₂O [ No CAS ]

Reference： [1]Acta Crystallographica, Section C: Crystal Structure Communications,2010,vol. 66,p. m266-m268

34
[ 636-73-7 ]
[ 100-97-0 ]
[ 7732-18-5 ]
[ 563-63-3 ]
2Ag⁽¹⁺⁾*(CH₂)2N(CH₂)N(CH₂)N(CH₂)N(CH₂)*2(C₅H₄N)SO₃^(1-)*2H₂O=[Ag₂(H₂O)((C₅H₄N)SO₃)2(C₆H₁₂N₄)]*H₂O [ No CAS ]

Reference： [1]Inorganic Chemistry Communications,2011,vol. 14,p. 172 - 175

35
[ 53199-31-8 ]
[ 456-45-1 ]
[ 563-63-3 ]
[ 1360860-56-5 ]

Reference： [1]Journal of the American Chemical Society,2012,vol. 134,p. 3683 - 3686

36
[ 28314-80-9 ]
[ 563-63-3 ]
(silver)(2,4,6-trifluorobenzoate)(H₂O) [ No CAS ]

Reference： [1]Zeitschrift fur Anorganische und Allgemeine Chemie,2012,vol. 638,p. 1424 - 1431

37
[ 563-63-3 ]
[ 65039-09-0 ]
[ 143314-17-4 ]

Reference： [1]Green Chemistry,2012,vol. 14,p. 2738 - 2746,9

38
[ 1092114-59-4 ]
[ 563-63-3 ]
[ 1409933-15-8 ]

Reference： [1]ACS Medicinal Chemistry Letters,2013,vol. 4,p. 22 - 26

39
[ 91-76-9 ]
[ 563-63-3 ]
[ 1448514-17-7 ]

Reference： [1]Russian Journal of Coordination Chemistry,2013,vol. 39,p. 293 - 296
Koord. Khim.,2013,vol. 39,p. 293 - 296

40
[ 4488-22-6 ]
C₄₀H₇₆N₂O₂⁽²⁺⁾*2NO₃^(1-) [ No CAS ]
[ 563-63-3 ]
[ 18544-54-2 ]
C₁₀₂H₁₆₅CoN₆O₄⁽⁴⁺⁾*4NO₃^(1-) [ No CAS ]

Reference： [1]Dalton Transactions,2013,vol. 42,p. 9245 - 9254

41
[ 563-63-3 ]
[ 143063-89-2 ]
[ 3663-34-1 ]

Reference： [1]European Journal of Organic Chemistry,2013,p. 6027 - 6031

42
[ 7732-18-5 ]
[ 563-63-3 ]
[ 17625-03-5 ]
[ 172606-21-2 ]
[Ag₂(1,4-bis(pyrazolylmethyl)benzene)₂(3-sulfobenzoate dianion)]*4H₂O [ No CAS ]

Reference： [1]RSC Advances,2014,vol. 4,p. 14691 - 14699

43
[ 499-49-0 ]
[ 563-63-3 ]
[ 39677-03-7 ]
Ag(1,1'-(1,4-butanediyl)bis-1H-benzimidazole)(Hmip) [ No CAS ]

Reference： [1]Transition Metal Chemistry,2014,vol. 39,p. 477 - 485

44
[ 563-63-3 ]
[ 2304-30-5 ]
[ 30345-49-4 ]

Reference： [1]Green Chemistry,2016,vol. 18,p. 3286 - 3294
[2]ChemSusChem,2014,vol. 7,p. 1422 - 1434

45
[ 499-49-0 ]
[ 1391611-22-5 ]
[ 563-63-3 ]
[silver(I)(5-methylisophthalic acid(-H))(1,6-bis(5,6-dimethylbenzimidazol-1-yl)hexane)] monohydrate [ No CAS ]

Reference： [1]Transition Metal Chemistry,2014,vol. 39,p. 535 - 541

46
[ 563-63-3 ]
[ 65039-08-9 ]
[ 143314-17-4 ]

Yield	Reaction Conditions	Operation in experiment
	In water; at 20℃; for 6h;	The second stage was conversion to the acetate salt: [EMIM]Br (0.50 mol) was dissolved in water (150 mL) and added slowly into Ag(CH3COO) aqueous solution (0.50 mol in 250 mL). The mixture was stirred at room temperature for 6 h, followed by filtration to remove AgBr. Charcoal was added to the filtrate in order to remove any impurities (indicated by color), then refrigerated overnight. After filtering off the charcoal, water was removed from the filtrate through rotary evaporation under vacuum at 70 C. The obtained light yellow liquid was dried in a vacuum oven for 48 h at 80 C. The synthesized [EMIM]Ac (100 mg) dissolved in D2O (0.5 mL) for 1H NMR measurement. Multiplicities are reported as s (singlet), d (doublet), t (triplet) and m (multiplet). 1H NMR (400 MHz, D2O, delta ppm): 1.38 (t, 3H, -CH3), 1.77 (s, 3H, -CH2CH3), 3.78 (s, 3H, OOCH2CH3), 4.13 (m, 2H, OOCH2CH3), 7.33 (s, 1H, -N-CH = CH-), 7.39 (s, 1H, -N-CH = CH-), 8.63 (s, 1H, -N = CH-N-).

Reference： [1]Chemical Communications,2017,vol. 53,p. 11154 - 11156
[2]Physical Chemistry Chemical Physics,2013,vol. 15,p. 20480 - 20495
[3]Carbohydrate Polymers,2015,vol. 121,p. 348 - 354

47
[ 109073-77-0 ]
[ 563-63-3 ]
C₂₄H₂₄AgN₄O₄⁽¹⁺⁾*C₂H₃O₂^(1-) [ No CAS ]

Reference： [1]Journal of Materials Chemistry C,2014,vol. 2,p. 8780 - 8788

48
[ 499-49-0 ]
[ 845712-67-6 ]
[ 563-63-3 ]
C₂₄H₂₂N₄*C₉H₇O₄^(1-)*Ag⁽¹⁺⁾ [ No CAS ]

Reference： [1]Zeitschrift fur Anorganische und Allgemeine Chemie,2015,vol. 641,p. 903 - 910

49
[ 42097-42-7 ]
[ 563-63-3 ]
[ 127-09-3 ]
[ 753-73-1 ]
[(SnMe2)4O2(2,6-lutidine-α²,3-diol(-H))2](OAc)₂ [ No CAS ]