CAS Registry Number: 40133-07-1

Name:

Benzo[b]​thiophene-​2-​carboxylic acid, 4,​5,​6,​7-​tetrahydro-
4,​5,​6,​7-​Tetrahydrobenzo[b]​thiophene-​2-​carboxylic acid 

Chemical Formula: C9H10O2S
Exact Mass: 182.04
Molecular Weight: 182.24
m/z: 182.04 (100.0%), 183.04 (10.6%), 184.04 (5.0%)

InChI: InChI=1S/C9H10O2S/c10-9(11)8-5-6-3-1-2-4-7(6)12-8/h5H,1-4H2,(H,10,11)
InChIKey: ROLXOQXKNDKXTA-UHFFFAOYSA-N
Canonical SMILES : C1CCC2=C(C1)C=C(S2)C(=O)O

Specification

98%

1. (1) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
2. (2) Buu-Hoi, Ng. Ph.; Bulletin de la Societe Chimique de France 1958, V3, P359-61 CAPLUS
3. (3) Cagniant, P.; Bulletin de la Societe Chimique de France 1953, P62-9 CAPLUS