AG001D0Z

14542-16-6 | Sodium 4-methyl-1,3-thiazole-2-carboxylate

AG001D0Z

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CAS Number	14542-16-6
Catalog Number	AG001D0Z(AGN-PC-03S6TR)
Chemical Name	Sodium 4-methyl-1,3-thiazole-2-carboxylate
IUPAC Name	4-methyl-1,3-thiazole-2-carboxylic acid
InChI	InChI=1S/C5H5NO2S/c1-3-2-9-4(6-3)5(7)8/h2H,1H3,(H,7,8)
InChI Key	GNGDWDFLILPTKL-UHFFFAOYSA-N
MDL Number	MFCD07377486
Molecular Formula	C5H5NO2S
Molecular Weight	143.1637
SMILES	O=C(O)c1nc(cs1)C
Synonyms	4-methylthiazole-2-carboxylic acid, 14542-16-6, 4-METHYL-1,3-THIAZOLE-2-CARBOXYLIC ACID, 4-Methyl-thiazole-2-carboxylic acid, 2-Thiazolecarboxylic acid, 4-methyl-, 2-Thiazolecarboxylicacid, 4-methyl-, MFCD07377486, 4-Methyl-1,3-thiazole-2-carboxylic acid, 97%, 14542-16-6 4-Methyl-1,3-thiazole-2-carboxylic acid, ACMC-209cuz, 4-methyl-2-carboxythiazole, KSC173Q1T, SCHEMBL128971, CTK0H3819, 4-methylthiazole-2-carboxylicacid, DTXSID20626266, GNGDWDFLILPTKL-UHFFFAOYSA-N, 4-methyl-2-thiazolecarboxylic acid, KS-00000CQ4, ANW-20937, CM-935, FC0654, FC0836, HT1074, SBB053102, WT1939, ZINC11764179, AKOS006380115, CS-W008124, PB26270, PS-4424, RP01356, RTR-005729, TRA0036117, AC-25226, AJ-60120, AK-26651, BC675561, BR-26651, QC-10340, 4-Methyl-1?3-thiazole-2-carboxylic acid, AB0028086, DB-031404, ST2411560, TR-005729, 4CH-016214, AM20080346, FT-0650314, X0105, B-7272, 542M166, A808367, I09-0198, W-205623, C5H5NO2S, ACN-031692, 4-Methyl-1,3-thiazole-2-carboxylicacid, C2235, 4-Methylthiazole-2-carboxylic acid, 95% - 1G 1g,

Complexity	128
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	143.004g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	143.16g/mol
Monoisotopic Mass	143.004g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	78.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

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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