AG007QFN

120237-76-5 | 5-Methylthiazole-4-carboxylic acid

AG007QFN

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CAS Number	120237-76-5
Catalog Number	AG007QFN(AGN-PC-000FGG)
Chemical Name	5-Methylthiazole-4-carboxylic acid
IUPAC Name	5-methyl-1,3-thiazole-4-carboxylic acid
InChI	InChI=1S/C5H5NO2S/c1-3-4(5(7)8)6-2-9-3/h2H,1H3,(H,7,8)
InChI Key	OIWNDJQQIMISPC-UHFFFAOYSA-N
MDL Number	MFCD06738813
Molecular Formula	C5H5NO2S
Molecular Weight	143.1637
SMILES	O=C(C1=C(C)SC=N1)O
Synonyms	5-Methylthiazole-4-carboxylic acid, 120237-76-5, 5-methyl-1,3-thiazole-4-carboxylic acid, 5-Methyl-thiazole-4-carboxylic acid, 5-Methylthiazole-4-carboxylicacid, ACMC-209a6x, SCHEMBL107379, CTK0H3772, KS-00000JWQ, DTXSID10555970, OIWNDJQQIMISPC-UHFFFAOYSA-N, 4-Carboxy-5-methyl-1,3-thiazole, ALBB-022320, 4-Thiazolecarboxylicacid, 5-methyl-, ANW-17479, MFCD06738813, RW3355, SBB053128, ZINC20357791, AKOS006293642, AB27941, CS-W004929, DS-1437, PS-5012, QC-1880, RP01355, RTC-069225, AJ-77178, AK-25323, BC652152, BL001514, BR-25323, EN000242, SC-43511, AB0033934, DB-011451, ST2418832, TC-069225, 4CH-012642, FT-0650434, X8003, 4-THIAZOLECARBOXYLIC ACID, 5-METHYL-, B-6617, 5-methyl-thiazole-4-carboxylic acid, AldrichCPR, 237M765, I09-0993, W-205087, C5H5NO2S, ACN-027133, A2514, C2284, 61323-26-0,

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	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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