CAS Registry Number: 146381-88-6

Name:

2-​Thiophenecarboxylic acid, 3-​[(2-​chloroacetyl)​amino]​-​, methyl ester
2-​Thiophenecarboxylic acid, 3-​[(chloroacetyl)​amino]​-​, methyl ester (9CI) 

Chemical Formula: C8H8ClNO3S
Exact Mass: 232.99
Molecular Weight: 233.67
m/z: 232.99 (100.0%), 234.99 (36.6%), 233.99 (9.8%), 235.99 (3.6%), 236.98 (1.4%)
Elemental Analysis: C, 41.12; H, 3.45; Cl, 15.17; N, 5.99; O, 20.54; S, 13.72

InChI: InChI=1S/C8H8ClNO3S/c1-13-8(12)7-5(2-3-14-7)10-6(11)4-9/h2-3H,4H2,1H3,(H,10,11)
InChIKey: UQIQUQQCIXVKLY-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1=C(C=CS1)NC(=O)CCl

Specification

98%

Faming Zhuanli Shenqing (2013), CN 102964354 A 20130313.                                 

Faming Zhuanli Shenqing (2013), CN 102875566 A 20130116.