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CAS Number: 4088-84-0
2-fluoro-5-(trifluoromethyl)benzonitrile

Structure

2-fluoro-5-(trifluoromethyl)benzonitrile
Name: 2-fluoro-5-(trifluoromethyl)benzonitrile
Synonyms:
General Information
Product Number: 4088840
CAS Registry Number: 4088-84-0
Name:
        Benzonitrile, 2-​fluoro-​5-​(trifluoromethyl)​-
        m-​Tolunitrile, α,​α,​α,​6-​tetrafluoro- (7CI,​8CI); 2-​Fluoro-​5-​(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/c9-7-2-1-6(8(10,11)12)3-5(7)4-13/h1-3H
InChIKey: LCLVMSCLLULGRY-UHFFFAOYSA-N
Canonical SMILES : C1=CC(=C(C=C1C(F)(F)F)C#N)F
 
Thermal Properties Value Condition Note
Boiling Point 99 °C Press: 27 Torr (1)CAS

Specification

98%

References
  1. (1) Finger, G. C.; Chemical Communications (London) 1965, (18), P430-1 CAPLUS
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