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CAS Number: 79544-29-9
2-fluoro-6-iodobenzonitrile

Structure

2-fluoro-6-iodobenzonitrile
Name: 2-fluoro-6-iodobenzonitrile
Synonyms:
General Information
Product Number: 79544299

CAS Registry Number 79544-29-9
Name:
Benzonitrile, 2-​fluoro-​6-​iodo-
2-Fluoro-6-iodobenzonitrile
6-Fluoro-2-iodobenzonitrile

 

Chemical Formula: C7H3FIN
Exact Mass: 246.93
Molecular Weight: 247.01
m/z: 246.93 (100.0%), 247.93 (7.9%)

 

InChI:InChI=1S/C7H3FIN/c8-6-2-1-3-7(9)5(6)4-10/h1-3H

InChI Key:FAACTMVXBNSPJA-UHFFFAOYSA-N

Canonical SMILES:C1=CC(=C(C(=C1)I)C#N)F

 

Thermal Properties Value Condition Note
Melting Point 48.5-50.5 °C   (1)IC

Specification

98%

References
  1. (1) Hynes, John B.; Journal of Heterocyclic Chemistry 1988, V25(4), P1173-7 CAPLUS
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