CAS Registry Number: 23799-60-2

Name:

Benzo[b]​thiophene-​3-​acetonitrile, 5-​chloro-
5-​Chlorobenzo[b]​thiophene-​3-​acetonitrile 

Chemical Formula: C10H6ClNS
Exact Mass: 206.99
Molecular Weight: 207.68
m/z: 206.99 (100.0%), 208.99 (36.6%), 207.99 (12.0%), 209.99 (4.3%), 210.98 (1.4%)

InChI: InChI=1S/C10H6ClNS/c11-8-1-2-10-9(5-8)7(3-4-12)6-13-10/h1-2,5-6H,3H2
InChIKey: JTPXNKOVUOJIKL-UHFFFAOYSA-N
Canonical SMILES : C1=CC2=C(C=C1Cl)C(=CS2)CC#N

Specification

98%

PCT Int. Appl. (2008), WO 2008153937 A2 20081218.                                  

PCT Int. Appl. (2007), WO 2007006734 A1 20070118.