AG000TG4

126909-38-4 | 5-Thiazolecarboxylic acid, 2-methoxy-4-methyl-, sodium salt

AG000TG4

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CAS Number	126909-38-4
Catalog Number	AG000TG4(AGN-PC-010KRC)
Chemical Name	5-Thiazolecarboxylic acid, 2-methoxy-4-methyl-, sodium salt
IUPAC Name	2-methoxy-4-methyl-1,3-thiazole-5-carboxylic acid
InChI	InChI=1S/C6H7NO3S/c1-3-4(5(8)9)11-6(7-3)10-2/h1-2H3,(H,8,9)
InChI Key	NNMGTKSNBXYSER-UHFFFAOYSA-N
MDL Number	MFCD08456936
Molecular Formula	C6H7NO3S
Molecular Weight	173.1897
SMILES	O=C(C1=C(C)N=C(OC)S1)O
Synonyms	126909-38-4, 2-methoxy-4-methyl-1,3-thiazole-5-carboxylic acid, 2-methoxy-4-methylthiazole-5-carboxylic acid, 5-Thiazolecarboxylic acid, 2-methoxy-4-methyl-, 2-METHOXY-4-METHYL-THIAZOLE-5-CARBOXYLIC ACID, SCHEMBL8307559, CTK4B5407, DTXSID50586182, NNMGTKSNBXYSER-UHFFFAOYSA-N, ALBB-022841, BB_SC-05879, ZX-AN021355, ZX-CM006806, 1762AJ, BBL011121, FCH861358, MFCD08456936, STK802391, ZINC19093085, AKOS000320807, MCULE-8113684520, AJ-72014, 2-methoxy-4-methylthiazole-5carboxylic acid, AB0218677, AX8160414, Y-3903, 2-methoxy-4-methyl-thiazole-5-carboxylic acid, AldrichCPR, C6H7NO3S,

Complexity	164
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	173.015g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	173.186g/mol
Monoisotopic Mass	173.015g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	87.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P233-P260-P261-P264-P271-P280-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
UN Code

Certificate of Analysis

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