AG008VEH

1060816-04-7 | 2-cyclopropyl-1,3-oxazole-4-carboxylic acid

AG008VEH

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CAS Number	1060816-04-7
Catalog Number	AG008VEH(AGN-PC-0WB5OX)
Chemical Name	2-cyclopropyl-1,3-oxazole-4-carboxylic acid
IUPAC Name	2-cyclopropyl-1,3-oxazole-4-carboxylic acid
InChI	InChI=1S/C7H7NO3/c9-7(10)5-3-11-6(8-5)4-1-2-4/h3-4H,1-2H2,(H,9,10)
InChI Key	BDAWHHUYCSZZAG-UHFFFAOYSA-N
MDL Number	MFCD12026856
Molecular Formula	C7H7NO3
Molecular Weight	153.1354
SMILES	C(=O)(O)c1nc(oc1)C1CC1
Synonyms	2-cyclopropyl-1,3-oxazole-4-carboxylic acid, 1060816-04-7, 2-Cyclopropyloxazole-4-carboxylic acid, 2-Cyclopropyl-oxazole-4-carboxylic acid, SCHEMBL12984738, CTK7J0681, DTXSID00649216, BDAWHHUYCSZZAG-UHFFFAOYSA-N, ALBB-004270, MFCD12026856, STK503055, ZINC34924955, AKOS005171270, 2-Cyclopropyl-4-oxazolecarboxylic Acid, AB65286, RTR-058124, 4-Oxazolecarboxylic acid, 2-cyclopropyl-, AJ-90325, SY058465, TR-058124, X6500, MFCD12026856 (95%), A-6795, 2-cyclopropyl-1,3-oxazole-4-carboxylic acid(SALTDATA, 2-cyclopropyl-1,3-oxazole-4-carboxylic acid, AldrichCPR, C7H7NO3, 2,5-Dichloro-4-methoxybenzenesulfonyl chloride,

Complexity	179
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	153.043g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	153.137g/mol
Monoisotopic Mass	153.043g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	63.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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