AG004DJ3

875237-46-0 | 2-Hydroxy-4-methylthiazole-5-carboxylic acid

AG004DJ3

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CAS Number	875237-46-0
Catalog Number	AG004DJ3(AGN-PC-01NG6R)
Chemical Name	2-Hydroxy-4-methylthiazole-5-carboxylic acid
IUPAC Name	4-methyl-2-oxo-3H-1,3-thiazole-5-carboxylic acid
InChI	InChI=1S/C5H5NO3S/c1-2-3(4(7)8)10-5(9)6-2/h1H3,(H,6,9)(H,7,8)
InChI Key	NVHAAIMFHOSMHD-UHFFFAOYSA-N
MDL Number	MFCD14706171
Molecular Formula	C5H5NO3S
Molecular Weight	159.1631
SMILES	OC1=NC(=C(S1)C(=O)O)C
Synonyms	2-hydroxy-4-methylthiazole-5-carboxylic acid, 875237-46-0, 2-hydroxy-4-methylthiazole-5-carboxylicacid, 4-methyl-2-oxo-2,3-dihydro-1,3-thiazole-5-carboxylic acid, 2-hydroxy-4-methyl-1,3-thiazole-5-carboxylic acid, 4-methyl-2-oxo-2,3-dihydrothiazole-5-carboxylic acid, SCHEMBL9519626, 4-Methyl-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid, 5-thiazolecarboxylic acid, 2,3-dihydro-4-methyl-2-oxo-, CTK3E6644, KS-00000HPL, DTXSID60591863, ALBB-027618, ANW-50173, BBL036810, MFCD11904862, STL407452, ZINC33503319, AKOS015856140, AKOS015948414, MCULE-8001416115, RP22253, AJ-86166, AK-32105, AM807150, BR-32105, DS-11746, EN002491, AB0027174, DB-076998, TR-027516, 4CH-008537, FT-0740842, ST24028037, W8979, S-5197, I09-1769, J-509640, 5-Thiazolecarboxylicacid, 2,3-dihydro-4-methyl-2-oxo-, 4-METHYL-2-OXO-3H-1,3-THIAZOLE-5-CARBOXYLIC ACID, C5H5NO3S, T1800,

Complexity	233
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	158.999g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	159.159g/mol
Monoisotopic Mass	158.999g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	91.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

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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