AG001Z85

173850-41-4 | ethyl 1,2-oxazole-5-carboxylate

AG001Z85

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CAS Number	173850-41-4
Catalog Number	AG001Z85(AGN-PC-0N93N2)
Chemical Name	ethyl 1,2-oxazole-5-carboxylate
IUPAC Name	ethyl 1,2-oxazole-5-carboxylate
InChI	InChI=1S/C6H7NO3/c1-2-9-6(8)5-3-4-7-10-5/h3-4H,2H2,1H3
InChI Key	JOWMDIFULFYASV-UHFFFAOYSA-N
MDL Number	MFCD18830699
Molecular Formula	C6H7NO3
Molecular Weight	141.1247
SMILES	O=C(C1=CC=NO1)OCC
Synonyms	Ethyl isoxazole-5-carboxylate, 173850-41-4, Ethyl 1,2-oxazole-5-carboxylate, isoxazole-5-carboxylic acid ethyl ester, JOWMDIFULFYASV-UHFFFAOYSA-N, 5-ISOXAZOLECARBOXYLICACID,ETHYLESTER, 5-ISOXAZOLECARBOXYLIC ACID ETHYL ESTER, SCHEMBL916156, CTK4D4782, DTXSID70443627, KS-00000P6U, 8975AA, ANW-73414, MFCD18830699, ZINC39087307, 5-Isoxazolecarboxylic acid,ethyl ester, 5-Isoxazolecarboxylicacid, ethyl ester, AKOS009493269, 5-Isoxazolecarboxylic acid, ethyl ester, AJ-98140, AK-68489, AS-10633, DB-003703, TC-162159, CS-0044017, FT-0720203, C6H7NO3, CID10701915,

Complexity	126
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	141.043g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	141.126g/mol
Monoisotopic Mass	141.043g/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
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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