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CAS 886501-14-0

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4-fluoro-3-(trifluoromethoxy)benzonitrile

Description:
4-Fluoro-3-(trifluoromethoxy)benzonitrile is an organic compound characterized by its aromatic structure, which includes a benzene ring substituted with a fluorine atom, a trifluoromethoxy group, and a nitrile functional group. The presence of the trifluoromethoxy group contributes to its unique electronic properties, enhancing its reactivity and solubility in various solvents. The compound is typically a solid at room temperature and may exhibit moderate to high stability under standard conditions. Its molecular structure suggests potential applications in pharmaceuticals, agrochemicals, or as an intermediate in organic synthesis due to the presence of both electron-withdrawing and electron-donating groups. The fluorine atoms in the trifluoromethoxy group can significantly influence the compound's lipophilicity and biological activity. Additionally, the nitrile group can participate in various chemical reactions, making this compound of interest in synthetic organic chemistry. Safety data should be consulted for handling, as halogenated compounds can pose environmental and health risks.
Formula:C8H3F4NO
InChI:InChI=1/C8H3F4NO/c9-6-2-1-5(4-13)3-7(6)14-8(10,11)12/h1-3H
SMILES:c1cc(c(cc1C#N)OC(F)(F)F)F
Synonyms:
  • Benzonitrile, 4-fluoro-3-(trifluoromethoxy)-
  • Ncr Df Coxfff
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