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CAS Number: 194853-86-6
4-fluoro-2-(trifluoromethyl)benzonitrile

Structure

4-fluoro-2-(trifluoromethyl)benzonitrile
Name: 4-fluoro-2-(trifluoromethyl)benzonitrile
Synonyms:
General Information
Product Number: 194853866
CAS Registry Number: 194853-86-6
Name:
        Benzonitrile, 4-​fluoro-​2-​(trifluoromethyl)​-
        2-​Trifluoromethyl-​4-​fluorobenzonitrile; 4-​Fluoro-​2-​(trifluoromethyl)​benzonitrile 
 
Chemical Formula: C8H3F4N
Exact Mass: 189.02
Molecular Weight: 189.11
m/z: 189.02 (100.0%), 190.02 (9.0%)
Elemental Analysis: C, 50.81; H, 1.60; F, 40.18; N, 7.41
 
InChI: InChI=1S/C8H3F4N/c9-6-2-1-5(4-13)7(3-6)8(10,11)12/h1-3H
InChIKey: LCCPQUYXMFXCAC-UHFFFAOYSA-N
Canonical SMILES : C1=CC(=C(C=C1F)C(F)(F)F)C#N

Specification

98%

References

PCT Int. Appl. (2014), WO 2014023723 A1 20140213. 

PCT Int. Appl. (2014), WO 2014013309 A1 20140123. 

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