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CAS Number: 63927-22-0
8-bromoisoquinoline

Structure

8-bromoisoquinoline
Name: 8-bromoisoquinoline
Synonyms:
General Information
Product Number: 63927220

CAS Registry Number 63927-22-0
Name:
Isoquinoline, 8-?bromo-
8-Bromoisoquinoline

 

Chemical Formula: C9H6BrN
Exact Mass: 206.97
Molecular Weight: 208.05
m/z: 206.97 (100.0%), 208.97 (97.3%), 207.97 (10.2%), 209.97 (9.5%)

 

InChI:InChI=1S/C9H6BrN/c10-9-3-1-2-7-4-5-11-6-8(7)9/h1-6H

InChI Key:DPRIHFQFWWCIGY-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C=NC=C2)C(=C1)Br

 

Thermal Properties Value Condition Note
Melting Point 75-77 °C Solv: hexane (110-54-3) (1)CAS

Specification

98%

References
  1. (1) Graulich, Amaury; Journal of Medicinal Chemistry 2005, V48(15), P4972-4982 CAPLUS
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