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CAS Number: 318276-72-1
6-bromocinnoline

Structure

 6-bromocinnoline
Name: 6-bromocinnoline
Synonyms:
General Information
Product Number: 318276721

CAS Registry Number 318276-72-1
Name:
Cinnoline, 6-?bromo-
6-Bromocinnoline

 

Chemical Formula: C8H5BrN2
Exact Mass: 207.96
Molecular Weight: 209.04
m/z: 207.96 (100.0%), 209.96 (97.3%), 210.96 (9.1%), 208.97 (8.7%)

 

InChI:InChI=1S/C8H5BrN2/c9-7-1-2-8-6(5-7)3-4-10-11-8/h1-5H

InChI Key:NUILLMMTUCMJNA-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C=CN=N2)C=C1Br

 

Thermal Properties Value Condition Note
Melting Point 129-130 °C   (2)CAS
Melting Point 127-128.1 °C   (3)CAS

Specification

98%
References
  1. (2) Schofield, K.; Journal of the Chemical Society 1950, P392-5 CAPLUS
  2. (3) Kimball, David B.; Journal of Organic Chemistry 2002, V67(18), P6395-6405 CAPLUS
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