CAS Registry Number: 90259-31-7

Name:

Benzoic acid, 2-​bromo-​6-​methyl-
o-​Toluic acid, 6-​bromo- (6CI); 2-​Bromo-​6-​methylbenzoic acid 

Chemical Formula: C8H7BrO2
Exact Mass: 213.96
Molecular Weight: 215.04
m/z: 213.96 (100.0%), 215.96 (97.3%), 214.97 (8.8%), 216.96 (8.4%)

InChI: InChI=1S/C8H7BrO2/c1-5-3-2-4-6(9)7(5)8(10)11/h2-4H,1H3,(H,10,11)
InChIKey: ICXBPDJQFPIBSS-UHFFFAOYSA-N
Canonical SMILES : CC1=C(C(=CC=C1)Br)C(=O)O

Specification

98%

PCT Int. Appl. (2013), WO 2013000994 A1 20130103. 

PCT Int. Appl. (2012), WO 2012140243 A1 20121018.