AG0018IP

13831-31-7 | Acetyl chloride, 2-​(acetyloxy)​-

AG0018IP

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CAS Number	13831-31-7
Catalog Number	AG0018IP(AGN-PC-0JKIQ4)
Chemical Name	Acetyl chloride, 2-​(acetyloxy)​-
EC Number	237-542-4
IUPAC Name	(2-chloro-2-oxoethyl) acetate
InChI	InChI=1S/C4H5ClO3/c1-3(6)8-2-4(5)7/h2H2,1H3
InChI Key	HZDNNJABYXNPPV-UHFFFAOYSA-N
MDL Number	MFCD00011535
Molecular Formula	C4H5ClO3
Molecular Weight	136.5337
SMILES	C(OC(=O)C)C(=O)Cl
UNII	Z4S19Y2F8S
Synonyms	ACETOXYACETYL CHLORIDE, 13831-31-7, 2-Chloro-2-oxoethyl acetate, 2-Acetoxyacetyl chloride, Acetoxyacetylchloride, UNII-Z4S19Y2F8S, Acetyl chloride, (acetyloxy)-, acetoxyacetic acid chloride, Acetoxyacetyl chloride, 97%, (Chlorocarbonyl)methyl acetate, Z4S19Y2F8S, MFCD00011535, EINECS 237-542-4, acetoxy acetylchloride, acetyloxyacetyl chloride, PubChem20920, AC1Q1LBT, (acetyloxy)acetyl chloride, Chloro-2-oxoethyl acetate, ACMC-1CUW5, AC1L1AU9, SCHEMBL5288, alpha-acetoxy acetyl chloride, KSC178S7J, (2-chloro-2-oxo-ethyl)acetate, (2-chloro-2-oxoethyl) acetate, Jsp002309, CTK0H8974, DTXSID20160579, EBD4552, Acetyl chloride, 2-(acetyloxy)-, HZDNNJABYXNPPV-UHFFFAOYSA-N, ALBB-013561, KS-000001EK, STR08793, ZINC2019437, ANW-20454, acetic acid chlorocarbonylmethyl ester, acetic acid chlorocarbonyl-methyl ester, AKOS000121009, RP20304, TRA0071041, acetic acid (2-chloro-2-oxoethyl) ester, CJ-07414, CJ-31435, SC-17748, AB0052928, DB-042424, RT-003581, BB 0261504, FT-0621815, (2-chloranyl-2-oxidanylidene-ethyl) ethanoate, K-4477, 30269-EP2270006A1, 30269-EP2272841A1, 30269-EP2277867A2, 30269-EP2280003A2, 30269-EP2311464A1, A807373, I14-1416, J-007117, J-519534, F0001-0475, tert-Butyl acetylenecarboxylate; Propiolic acid tert-butyl ester, Acetoxy acetyl chloride, C4-H5-Cl-O3, CID26297, ZINC02019437, Acetoxyacetyl chloride, 97% - 1G 1g, A1500,

Complexity	110
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	135.993g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	136.531g/mol
Monoisotopic Mass	135.993g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	43.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314-H335
Packing Group	Ⅱ
Precautionary statements	P261-P280-P305+P351+P338-P310
UN Code	UN 3265

Certificate of Analysis

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