CAS Registry Number: 871224-19-0

Name:

Benzoic acid, 3-​bromo-​2-​chloro-​, methyl ester
3-​Bromo-​2-​chlorobenzoic acid methyl ester; Methyl 3-​bromo-​2-​chlorobenzoate 

Chemical Formula: C8H6BrClO2
Exact Mass: 247.92
Molecular Weight: 249.49
m/z: 249.92 (100.0%), 247.92 (77.4%), 251.92 (24.1%), 248.93 (6.8%), 250.93 (6.7%), 250.92 (2.1%), 252.92 (2.1%)

InChI: InChI=1S/C8H6BrClO2/c1-12-8(11)5-3-2-4-6(9)7(5)10/h2-4H,1H3
InChIKey: OWPJVOSLLKRKQJ-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1=C(C(=CC=C1)Br)Cl

Specification

98%

PCT Int. Appl. (2013), WO 2013062892 A1 20130502.

PCT Int. Appl. (2013), WO 2013062900 A1 20130502.