AG00CISV

31698-88-1 | METHYL 2-OXAZOLECARBOXYLATE

AG00CISV

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CAS Number	31698-88-1
Catalog Number	AG00CISV(AGN-PC-09TAJX)
Chemical Name	METHYL 2-OXAZOLECARBOXYLATE
IUPAC Name	methyl 1,3-oxazole-2-carboxylate
InChI	InChI=1S/C5H5NO3/c1-8-5(7)4-6-2-3-9-4/h2-3H,1H3
InChI Key	GSKQTLDIWHGWSR-UHFFFAOYSA-N
MDL Number	MFCD07699294
Molecular Formula	C5H5NO3
Molecular Weight	127.0981
SMILES	COC(=O)C1=NC=CO1
Synonyms	Methyl oxazole-2-carboxylate, 31698-88-1, METHYL 1,3-OXAZOLE-2-CARBOXYLATE, AK109950, OXAZOLE-2-CARBOXYLIC ACID METHYL ESTER, SCHEMBL742254, KS-00000PWY, DTXSID40701569, METHYL 2-OXAZOLECARBOXYLATE, FCH856328, MFCD07699294, ZINC75852401, AKOS006285624, AB42108, DS-2740, ACM31698881, AJ-122026, AX8228243, DB-003745, ST2407309, 4CH-016836, FT-0703986, METHYL2-OXAZOLECARBOXYLATE, ACN-051342, C3036,

Complexity	115
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	127.027g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	127.099g/mol
Monoisotopic Mass	127.027g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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