CAS Registry Number: 643044-04-6

Name:

2-​Quinolinecarboxylic acid, 4,​7-​dichloro-​, methyl ester

Chemical Formula: C11H7Cl2NO2
Exact Mass: 254.99
Molecular Weight: 256.08
m/z: 254.99 (100.0%), 256.98 (63.9%), 255.99 (12.1%), 258.98 (10.2%), 257.99 (7.8%), 259.98 (1.3%), 256.99 (1.1%)
Elemental Analysis: C, 51.59; H, 2.76; Cl, 27.69; N, 5.47; O, 12.50

InChI: InChI=1S/C11H7Cl2NO2/c1-16-11(15)10-5-8(13)7-3-2-6(12)4-9(7)14-10/h2-5H,1H3
InChIKey: BSWADGMXDJAZCP-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1=NC2=C(C=CC(=C2)Cl)C(=C1)Cl

Specification

98%

PCT Int. Appl. (2004), WO 2004002960 A1 20040108.                                  

Inorganica Chimica Acta (2012), 393, 276-283.