CAS Registry Number: 886365-28-2

Name:

4-​Pyridinecarboxylic acid, 5-​bromo-​2-​chloro-​, methyl ester

Chemical Formula: C7H5BrClNO2
Exact Mass: 248.92
Molecular Weight: 250.48
m/z: 250.92 (100.0%), 248.92 (77.1%), 252.91 (24.0%), 251.92 (7.7%), 249.92 (6.2%), 253.92 (1.9%)
Elemental Analysis: C, 33.57; H, 2.01; Br, 31.90; Cl, 14.15; N, 5.59; O, 12.78

InChI: InChI=1S/C7H5BrClNO2/c1-12-7(11)4-2-6(9)10-3-5(4)8/h2-3H,1H3
InChIKey: ZGVAWYBJGMOKBV-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1=CC(=NC=C1Br)Cl

Specification

98%

PCT Int. Appl. (2014), WO 2014099696 A1 20140626.

PCT Int. Appl. (2011), WO 2011021678 A1 20110224.