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CAS Number: 34784-05-9
6-bromoisoquinoline

Structure

6-bromoisoquinoline
Name: 6-bromoisoquinoline
Synonyms:
General Information
Product Number: 34784059

CAS Registry Number 34784-05-9
Name:
Isoquinoline, 6-​bromo-
(Isoquinolin-6-yl)bromide
6-Bromoisoquinoline
NSC 229320

 

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/c10-9-2-1-8-6-11-4-3-7(8)5-9/h1-6H

InChI Key:ZTEATMVVGQUULZ-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C=CN=C2)C=C1Br

 

Thermal Properties Value Condition Note
Melting Point 42-43 °C   (5)IC
Melting Point 39 °C   (6)IC

Specification

98%

References
  1. (5) Miller, R. Bryan; Journal of Organic Chemistry 1980, V45(26), P5312-15 CAPLUS
  2. (6) Skinner, W. A.; Journal of Pharmaceutical Sciences 1976, V65(9), P1404-7 CAPLUS
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