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CAS 37526-65-1

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2-(trifluoromethylthio)benzonitrile

Description:
2-(Trifluoromethylthio)benzonitrile is an organic compound characterized by the presence of a benzonitrile moiety substituted with a trifluoromethylthio group. This compound features a benzene ring attached to a nitrile group (-C≡N) and a trifluoromethylthio group (-SCF3), which significantly influences its chemical properties. The trifluoromethylthio group is known for its electron-withdrawing characteristics, which can enhance the compound's reactivity in various chemical reactions. The presence of the nitrile group contributes to the compound's polarity and potential for hydrogen bonding, affecting its solubility in different solvents. Additionally, the trifluoromethylthio group can impart unique physical properties, such as increased lipophilicity and stability under certain conditions. This compound may be of interest in various fields, including pharmaceuticals and agrochemicals, due to its potential biological activity and utility in synthetic chemistry. As with many fluorinated compounds, it may exhibit distinct environmental and toxicological profiles that warrant careful handling and assessment.
Formula:C8H4F3NS
InChI:InChI=1/C8H4F3NS/c9-8(10,11)13-7-4-2-1-3-6(7)5-12/h1-4H
SMILES:c1ccc(c(c1)C#N)SC(F)(F)F
Synonyms:
  • 1,1,1,3,4-Pentachloro-2,2,3,4,4-Pentafluorobutane
  • 2-[(Trifluoromethyl)Sulfanyl]Benzonitrile
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