CAS Registry Number: 74772-16-0

Name:

2-​Thiophenecarboxylic acid, 3-​(1H-​pyrrol-​1-​yl)​-​, methyl ester

Chemical Formula: C10H9NO2S
Exact Mass: 207.04
Molecular Weight: 207.25
m/z: 207.04 (100.0%), 208.04 (11.0%), 209.03 (4.5%), 208.03 (1.2%), 209.04 (1.1%)
Elemental Analysis: C, 57.95; H, 4.38; N, 6.76; O, 15.44; S, 15.47

InChI: InChI=1S/C10H9NO2S/c1-13-10(12)9-8(4-7-14-9)11-5-2-3-6-11/h2-7H,1H3
InChIKey: FYNQCKPHPLFYDN-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1=C(C=CS1)N2C=CC=C2

Specification

98%

1. (1) Rault, Sylvain; Heterocycles 1980, V14(5), P651-2 CAPLUS
2. (2) Rault, Sylvain; Heterocycles 1983, V20(3), P477-80 CAPLUS
3. (3) Rault, Sylvain; Journal of Heterocyclic Chemistry 1983, V20(1), P17-21 CAPLUS