AG002JPL

208465-72-9 | 4-Oxazolecarboxylic acid, 2-(chloromethyl)-, methyl ester

AG002JPL

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CAS Number	208465-72-9
Catalog Number	AG002JPL(AGN-PC-0KKPCY)
Chemical Name	4-Oxazolecarboxylic acid, 2-(chloromethyl)-, methyl ester
IUPAC Name	methyl 2-(chloromethyl)-1,3-oxazole-4-carboxylate
InChI	InChI=1S/C6H6ClNO3/c1-10-6(9)4-3-11-5(2-7)8-4/h3H,2H2,1H3
InChI Key	CMUKPCIZFMTLKD-UHFFFAOYSA-N
MDL Number	MFCD06660133
Molecular Formula	C6H6ClNO3
Molecular Weight	175.5697
SMILES	ClCC=1OC=C(N1)C(=O)OC
Synonyms	208465-72-9, methyl 2-(chloromethyl)oxazole-4-carboxylate, methyl 2-(chloromethyl)-1,3-oxazole-4-carboxylate, Methyl (2-Chloromethyl)oxazole-4-carboxylate, 4-Oxazolecarboxylic acid, 2-(chloromethyl)-, methyl ester, Methyl 2-chloromethyl-4-oxazolecarboxylate, MFCD06660133, PubChem22375, AC1MC7XW, Methyl(2-chloromethyl)oxazole-4-carboxylate, SCHEMBL393999, CTK4E5288, DTXSID30376806, CMUKPCIZFMTLKD-UHFFFAOYSA-N, ZINC4198764, ANW-56287, SBB089093, AKOS005255693, CM-1293, RP02934, RTR-038789, AJ-48253, AK-24875, DS-10527, AB0040579, M2093M500, TR-038789, AM20080901, FT-0647001, TL80073499, Y8207, 2-(chloromethyl)-5-methyloxazole-4-carboxylate, C-1694, M50063, H112831, methyl 2-(chloro-methyl)-1,3-oxazole-4-carboxylate, W-206566, 2-chloromethyl-oxazole-4-carboxylic acid methyl ester, I14-11512, 2-(Chloromethyl)oxazole-4-carboxylic acid methyl ester, 2-Chloromethyl-oxazole-4-carboxylic acid methyl ester;, 4-Oxazolecarboxylicacid, 2-(chloromethyl)-, methyl ester, 2 - Chloromethyl - oxazole - 4 - carboxylic acid methyl ester;, C6H6ClNO3, ZINC04198764, CID2763199, A4533, methyl 2-(chloromethyl)oxazole-4-carboxylate, 95% - 1G 1g,

Complexity	153
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	175.004g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	175.568g/mol
Monoisotopic Mass	175.004g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

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