CAS Registry Number: 223671-13-4
 Name:

7-bromo-1,4-dichloroisoquinoline

Isoquinoline, 7-​bromo-​1,​4-​dichloro-

Chemical Formula: C9H4BrCl2N
Exact Mass: 274.89
Molecular Weight: 276.94
m/z: 276.89 (100.0%), 274.89 (62.0%), 278.89 (38.8%), 277.89 (10.0%), 278.88 (6.3%), 275.89 (6.3%), 280.88 (6.2%), 279.89 (4.4%)

InChI
InChI=1S/C9H4BrCl2N/c10-5-1-2-6-7(3-5)9(12)13-4-8(6)11/h1-4H
InChI Key
KWXXBZNOKYQKAI-UHFFFAOYSA-N
Canonical SMILES
C1=CC2=C(C=C1Br)C(=NC=C2Cl)Cl

Specification

98%

PCT Int. Appl. (2009), WO 2009060209 A1 20090514

Journal of Medicinal Chemistry (2007), 50(10), 2341-2351