AG007BLX

106833-79-8 | 2-Phenyloxazole-5-carboxylic acid

AG007BLX

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CAS Number	106833-79-8
Catalog Number	AG007BLX(AGN-PC-00NAHQ)
Chemical Name	2-Phenyloxazole-5-carboxylic acid
IUPAC Name	2-phenyl-1,3-oxazole-5-carboxylic acid
InChI	InChI=1S/C10H7NO3/c12-10(13)8-6-11-9(14-8)7-4-2-1-3-5-7/h1-6H,(H,12,13)
InChI Key	PPQVAHVZIBDHDB-UHFFFAOYSA-N
MDL Number	MFCD08361772
Molecular Formula	C10H7NO3
Molecular Weight	189.1675
SMILES	C1=C(OC(=N1)C2=CC=CC=C2)C(=O)O
Synonyms	2-phenyloxazole-5-carboxylic acid, 106833-79-8, 2-Phenyl-1,3-oxazole-5-carboxylic acid, 2-Phenyl-oxazole-5-carboxylic acid, 5-Oxazolecarboxylic acid, 2-phenyl-, 5-Oxazolecarboxylicacid, 2-phenyl-, EC-000.1791, ACMC-209vck, SCHEMBL2007486, CTK0H2663, KS-00000OOS, DTXSID40544993, PPQVAHVZIBDHDB-UHFFFAOYSA-N, 1468AA, ANW-44898, MFCD08361772, ZINC22114934, AKOS006287894, CS-W006692, MCULE-9604657030, NE63731, AJ-81035, AK-72856, BR-72856, DS-15258, TR-001353, ST24022379, 2 - Phenyl - 1,3 - oxazole - 5 - carboxylic acid, 2-Phenyl-1,3-oxazole-5-carboxylic acid, AldrichCPR, Z2306626555, C10H7NO3, 2-Phenyloxazole-5-carboxylicacid, ACN-044801,

Complexity	213
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	189.043g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	189.17g/mol
Monoisotopic Mass	189.043g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	63.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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