CAS Registry Number: 916792-09-1

Name:

Benzonitrile, 2-​bromo-​4-​fluoro-​6-​methyl-
2-​Bromo-​4-​fluoro-​6-​methylbenzonitrile 

Chemical Formula: C8H5BrFN
Exact Mass: 212.96
Molecular Weight: 214.03
m/z: 212.96 (100.0%), 214.96 (97.3%), 213.96 (9.0%), 215.96 (8.5%)
Elemental Analysis: C, 44.89; H, 2.35; Br, 37.33; F, 8.88; N, 6.54

InChI: InChI=1S/C8H5BrFN/c1-5-2-6(10)3-8(9)7(5)4-11/h2-3H,1H3
InChIKey: JHKAGGIPLGOTCY-UHFFFAOYSA-N
Canonical SMILES : CC1=CC(=CC(=C1C#N)Br)F

Specification

98%

PCT Int. Appl. (2014), WO 2014064149 A1 20140501. 

PCT Int. Appl. (2011), WO 2011006803 A1 20110120.