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CAS 401892-82-8

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3-(pentafluoro-lambda~6~-sulfanyl)benzonitrile

Description:
3-(Pentafluoro-lambda^6-sulfanyl)benzonitrile, with the CAS number 401892-82-8, is a chemical compound characterized by the presence of a benzonitrile moiety substituted at the 3-position with a pentafluorosulfanyl group. This compound features a sulfur atom bonded to five fluorine atoms, which imparts significant electronegativity and unique reactivity to the molecule. The presence of the nitrile functional group (-C≡N) contributes to its polar nature and potential for hydrogen bonding interactions. The pentafluorosulfanyl group enhances the compound's lipophilicity and may influence its solubility in organic solvents. Additionally, the fluorinated substituents can affect the compound's electronic properties, making it of interest in various applications, including materials science and medicinal chemistry. The stability of the compound is generally high due to the strong S-F bonds, although the reactivity can vary depending on the surrounding chemical environment. Overall, this compound exemplifies the intriguing properties of fluorinated organosulfur compounds in synthetic and applied chemistry.
Formula:C7H4F5NS
InChI:InChI=1/C7H4F5NS/c8-14(9,10,11,12)7-3-1-2-6(4-7)5-13/h1-4H
SMILES:c1cc(cc(c1)S(F)(F)(F)(F)F)C#N
Synonyms:
  • (3-Cyanophenyl)pentafluorosulfur
  • 3-(Pentafluorosulfur)benzonitrile
  • 3-(Pentafluorothio)benzonitrile
  • 3-Cyanophenylsulphur pentafluoride
  • 3-Cyanophenylsulfur pentafluoride
  • Sulfur, (3-cyanophenyl)pentafluoro-
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