AG0035FX

672948-03-7 | 2-Oxazolecarboxylic acid

AG0035FX

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CAS Number	672948-03-7
Catalog Number	AG0035FX(AGN-PC-00KBQL)
Chemical Name	2-Oxazolecarboxylic acid
IUPAC Name	1,3-oxazole-2-carboxylic acid
InChI	InChI=1S/C4H3NO3/c6-4(7)3-5-1-2-8-3/h1-2H,(H,6,7)
InChI Key	CQHYICHMGNSGQH-UHFFFAOYSA-N
MDL Number	MFCD04114935
Molecular Formula	C4H3NO3
Molecular Weight	113.0715
SMILES	O1C(=NC=C1)C(=O)O
Synonyms	2-OXAZOLECARBOXYLIC ACID, Oxazole-2-carboxylic acid, 672948-03-7, 1,3-oxazole-2-carboxylic acid, 2-Carboxy-oxazole, 2-Oxazolecarboxylicacid, oxazolecarboxylic, oxazolecarboxylic acid, Oxazole-2-carboxylicacid, ACMC-1B2J7, SCHEMBL287187, AMOT0347, CTK2F2631, DTXSID80514312, CQHYICHMGNSGQH-UHFFFAOYSA-N, ZINC2527143, ANW-44275, CO-117, FCH848969, MFCD04114935, AKOS006293920, AB19305, ACN-001748, RP19084, AJ-37830, AK-44335, AN-27634, QC-11810, SC-14504, DB-014955, ST2417138, TC-133020, AM20100620, C2495, FT-0742732, Z1844, Z-5657, 948O037, A835702, I14-8694, J-510194, 60999-22-6, C4H3NO3, 2-Cyano-4-methoxybenzaldehyde, 2-OXAZOLECARBOXYLIC ACID Sodium salt, 33123-68-1,

Complexity	104
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	113.011g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	113.072g/mol
Monoisotopic Mass	113.011g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	63.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.2

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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