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CAS 261763-16-0

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[3-Chloro-2-fluoro-6-(trifluoromethyl)phenyl]acetonitrile

Description:
[3-Chloro-2-fluoro-6-(trifluoromethyl)phenyl]acetonitrile, with the CAS number 261763-16-0, is an organic compound characterized by its complex structure featuring a phenyl ring substituted with multiple halogen atoms and a nitrile functional group. The presence of chlorine and fluorine atoms contributes to its unique chemical properties, including increased lipophilicity and potential reactivity in various chemical reactions. The trifluoromethyl group enhances the compound's electron-withdrawing characteristics, which can influence its behavior in biological systems and chemical synthesis. This compound is typically used in pharmaceutical research and development, particularly in the synthesis of biologically active molecules. Its physical properties, such as boiling point and solubility, are influenced by the halogen substituents, which can also affect its stability and reactivity. Overall, [3-Chloro-2-fluoro-6-(trifluoromethyl)phenyl]acetonitrile is a valuable compound in the field of medicinal chemistry and materials science, with applications that may extend to agrochemicals and other industrial uses.
Formula:C9H4ClF4N
InChI:InChI=1/C9H4ClF4N/c10-7-2-1-6(9(12,13)14)5(3-4-15)8(7)11/h1-2H,3H2
SMILES:c1cc(c(c(CC#N)c1C(F)(F)F)F)Cl
Synonyms:
  • Benzeneacetonitrile, 3-Chloro-2-Fluoro-6-(Trifluoromethyl)-
  • 3-Chloro-2-fluoro-6-(trifluoromethyl)phenylacetonitrile
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