CAS Registry Number: 14315-11-8

Name:

Benzo[b]​thiophene, 4-​methyl-
4-​Methylbenzo[b]​thiophene; 4-​Methylbenzothiophene 

Chemical Formula: C9H8S
Exact Mass: 148.03
Molecular Weight: 148.22
m/z: 148.03 (100.0%), 149.04 (9.8%), 150.03 (4.5%)

InChI: InChI=1S/C9H8S/c1-7-3-2-4-9-8(7)5-6-10-9/h2-6H,1H3
InChIKey: RPKWIZPGQZKQKY-UHFFFAOYSA-N
Canonical SMILES : CC1=C2C=CSC2=CC=C1

Specification

98%

1. (1) Kloetzel, Milton C.; Journal of Organic Chemistry 1953, V18, P1511-15 CAPLUS
2. (2) Clark, P. D.; Organic Magnetic Resonance 1976, V8(5), P252-7 CAPLUS
3. (3) Bobinger, Stefan; Environmental Science & Technology 2009, V43(21), P8119-8125 CAPLUS