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CAS Number: 13130-79-5
1-bromoisoquinolin-3-amine

Structure

1-bromoisoquinolin-3-amine
Name: 1-bromoisoquinolin-3-amine
Synonyms:
General Information
Product Number: 13130795

CAS Registry Number 13130-79-5
Name:
3-?Isoquinolinamine, 1-?bromo-
Isoquinoline, 3-amino-1-bromo- (7CI,8CI)
1-Bromo-3-isoquinolinamine
(1-Bromoisoquinolin-3-yl)amine
1-Bromoisoquinoline-3-amine
3-Amino-1-bromoisoquinoline

 

Chemical Formula: C9H7BrN2
Exact Mass: 221.98
Molecular Weight: 223.07
m/z: 221.98 (100.0%), 223.98 (97.4%), 222.98 (10.5%), 224.98 (9.6%)

 

InChI:InChI=1S/C9H7BrN2/c10-9-7-4-2-1-3-6(7)5-8(11)12-9/h1-5H,(H2,11,12)

InChI Key:PSQUIUNIVDKHJK-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C2C(=C1)C=C(N=C2Br)N

 

Thermal Properties Value Condition Note
Melting Point 153-154 °C   (3)CAS

Specification

98%

References
  1. (3) Johnson, Francis; US 3277096 1966 CAPLUS
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