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CAS Number: 405224-23-9
5-Bromo-2-chloro-3-cyanopyridine

Structure

5-Bromo-2-chloro-3-cyanopyridine
Name: 5-Bromo-2-chloro-3-cyanopyridine
Synonyms:
General Information
Product Number: 405224239
CAS Registry Number:
405224-23-9
Name:
3-Pyridinecarbonitrile, 5-bromo-2-chloro-
5-Bromo-2-chloronicotinonitrile 
 
Chemical Formula: C6H2BrClN2
Exact Mass: 215.91
Molecular Weight: 217.45
m/z: 217.91 (100.0%), 215.91 (77.3%), 219.90 (24.0%), 218.91 (6.5%), 216.91 (5.6%), 220.91 (1.6%)
Elemental Analysis: C, 33.14; H, 0.93; Br, 36.75; Cl, 16.30; N, 12.88
 
InChI: InChI=1S/C6H2BrClN2/c7-5-1-4(2-9)6(8)10-3-5/h1,3H
InChIKey: MQOHJAYYYVQBSH-UHFFFAOYSA-N
Canonical SMILES : C1=C(C(=NC=C1Br)Cl)C#N

Specification

98%

References
  1. (1) Shi, Jianyou; Bioorganic & Medicinal Chemistry Letters 2010, V20(14), P4273-4278 CAPLUS
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