CAS Registry Number: 757247-99-7

Name:

Benzonitrile, 4-​amino-​2-​chloro-​3-​fluoro-
4-​Amino-​2-​chloro-​3-​fluorobenzonitrile 

Chemical Formula: C7H4ClFN2
Exact Mass: 170.00
Molecular Weight: 170.57
m/z: 170.00 (100.0%), 172.00 (32.0%), 171.01 (7.6%), 173.01 (2.4%)

InChI: InChI=1S/C7H4ClFN2/c8-6-4(3-10)1-2-5(11)7(6)9/h1-2H,11H2
InChIKey: XSTLYVVLZCCQOC-UHFFFAOYSA-N
Canonical SMILES : C1=CC(=C(C(=C1C#N)Cl)F)N

Specification

98%

PCT Int. Appl. (2012), WO 2012119559 A1 20120913.                                 

PCT Int. Appl. (2011), WO 2011029392 A1 20110317.