AG001QE8

15901-66-3 | 5-Isothiazolecarboxylic acid, methyl ester

AG001QE8

SDS

COA

Price

$0.00

WARNING This product is not for human or veterinary use.

CAS Number	15901-66-3
Catalog Number	AG001QE8(AGN-PC-0NLG6Y)
Chemical Name	5-Isothiazolecarboxylic acid, methyl ester
IUPAC Name	methyl 1,2-thiazole-5-carboxylate
InChI	InChI=1S/C5H5NO2S/c1-8-5(7)4-2-3-6-9-4/h2-3H,1H3
InChI Key	SEHOXOITNPIETO-UHFFFAOYSA-N
MDL Number	MFCD07369963
Molecular Formula	C5H5NO2S
Molecular Weight	143.1637
SMILES	COC(C1SN=CC=1)=O
Synonyms	15901-66-3, methyl isothiazole-5-carboxylate, Isothiazole-5-carboxylic acid methyl ester, methyl 1,2-thiazole-5-carboxylate, Isothiazole-5-carboxylicacidmethylester, 5-Isothiazolecarboxylic acid methyl ester, SCHEMBL5473276, CTK4C9921, DTXSID20625234, 4171AJ, MFCD07369963, ZINC12650022, AKOS006343266, AC-6607, AN-9846, 5-Isothiazolecarboxylicacid,methyl ester, AJ-62919, AS-37934, 5-Isothiazolecarboxylic acid, methyl ester, DB-064256, TR-006714, A3513, FT-0647957, A-2433, I14-14450, isothiazole-5-carboxylic acid methyl ester, AldrichCPR, C5H5NO2S, ACN-044740,

Complexity	118
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	0
Isotope Atom Count	0
Molecular Weight	143.16g/mol
Monoisotopic Mass	143.004g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	67.4A^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
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number