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CAS 101066-87-9

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4-IODO-2-(TRIFLUOROMETHYL)BENZONITRILE

Description:
4-Iodo-2-(trifluoromethyl)benzonitrile is an organic compound characterized by its aromatic structure, which includes a benzene ring substituted with both an iodine atom and a trifluoromethyl group, as well as a nitrile functional group. The presence of the iodine atom contributes to its reactivity, particularly in nucleophilic substitution reactions, while the trifluoromethyl group enhances its lipophilicity and can influence its electronic properties. The nitrile group (-C≡N) is known for its polar character and can participate in various chemical reactions, including hydrolysis and reduction. This compound is typically used in organic synthesis and may serve as an intermediate in the production of pharmaceuticals or agrochemicals. Its physical properties, such as melting point, boiling point, and solubility, can vary based on the specific conditions and purity of the substance. Safety precautions should be observed when handling this compound due to the presence of iodine and fluorinated groups, which can pose health and environmental risks.
Formula:C8H3F3IN
InChI:InChI=1/C8H3F3IN/c9-8(10,11)7-3-6(12)2-1-5(7)4-13/h1-3H
SMILES:c1cc(cc(c1C#N)C(F)(F)F)I
Synonyms:
  • 4-Cyano-3-(trifluoromethyl)iodobenzene
  • 2-(Trifluoromethyl)-4-iodobenzonitrile
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