AG0015DI

1216012-87-1 | 5-Oxazolecarboxylic acid, 2-methyl-

AG0015DI

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CAS Number	1216012-87-1
Catalog Number	AG0015DI(AGN-PC-041WL6)
Chemical Name	5-Oxazolecarboxylic acid, 2-methyl-
IUPAC Name	2-methyl-1,3-oxazole-5-carboxylic acid
InChI	InChI=1S/C5H5NO3/c1-3-6-2-4(9-3)5(7)8/h2H,1H3,(H,7,8)
InChI Key	MARKCZHBQSQUHU-UHFFFAOYSA-N
MDL Number	MFCD12403806
Molecular Formula	C5H5NO3
Molecular Weight	127.0981
SMILES	Cc1ncc(o1)C(=O)O
Synonyms	2-Methyloxazole-5-carboxylic acid, 1216012-87-1, 2-Methyl-1,3-oxazole-5-carboxylic acid, 2-METHYL-OXAZOLE-5-CARBOXYLIC ACID, 2-methyl-5-Oxazolecarboxylic acid, 2-Methyloxazole-5-carboxylicacid, 5-Oxazolecarboxylic acid, 2-methyl-, SCHEMBL8303534, CTK8B9029, DTXSID60633358, KS-00000OL9, ANW-61861, MFCD12403806, ZINC40539292, AKOS006223023, ACN-029497, CS-W006682, AK-43778, QC-11464, SC-43630, SY034537, TS-01664, AJ-103393, ST2410149, TC-150606, Y5240, MFCD12403806 (95%), Z-6943, 2-methyl-1,3-oxazole-5-carboxylic acid, AldrichCPR, C5H5NO3,

Complexity	125
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	1
Isotope Atom Count	0
Molecular Weight	127.099g/mol
Monoisotopic Mass	127.027g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	63.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

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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