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CAS 886761-71-3

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3-Fluoro-4-(trifluoromethoxy)benzeneacetonitrile

Description:
3-Fluoro-4-(trifluoromethoxy)benzeneacetonitrile is an organic compound characterized by its aromatic structure, which includes a benzene ring substituted with a fluorine atom and a trifluoromethoxy group. The presence of the acetonitrile functional group introduces a nitrile (-C≡N) moiety, contributing to its reactivity and potential applications in various chemical reactions. This compound is typically a colorless to pale yellow liquid or solid, depending on its physical state at room temperature. It is known for its relatively low volatility and moderate solubility in organic solvents, making it useful in synthetic organic chemistry. The trifluoromethoxy group enhances the compound's electron-withdrawing properties, which can influence its reactivity and interactions with other chemical species. Additionally, the fluorine substituents can impart unique properties such as increased lipophilicity and stability, making it of interest in pharmaceuticals and agrochemicals. Safety data should be consulted for handling, as compounds with fluorinated groups can exhibit specific hazards.
Formula:C9H5F4NO
InChI:InChI=1S/C9H5F4NO/c10-7-5-6(3-4-14)1-2-8(7)15-9(11,12)13/h1-2,5H,3H2
InChI key:InChIKey=MIDNSRCOEGRXAX-UHFFFAOYSA-N
SMILES:O(C(F)(F)F)C1=C(F)C=C(CC#N)C=C1
Synonyms:
  • 3-Fluoro-4-(trifluoromethoxy)phenylacetonitrile
  • Benzeneacetonitrile, 3-fluoro-4-(trifluoromethoxy)-
  • 2-[3-Fluoro-4-(trifluoromethoxy)phenyl]acetonitrile
  • 3-Fluoro-4-(trifluoromethoxy)benzeneacetonitrile
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