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CAS 302912-40-9

:

1-fluoro-2-isothiocyanato-4-(trifluoromethyl)benzene

Description:
1-Fluoro-2-isothiocyanato-4-(trifluoromethyl)benzene, with the CAS number 302912-40-9, is an organic compound characterized by the presence of a fluorine atom, an isothiocyanate functional group, and a trifluoromethyl group attached to a benzene ring. This compound typically exhibits a pale yellow to light brown appearance and is known for its reactivity due to the isothiocyanate moiety, which can participate in various nucleophilic reactions. The trifluoromethyl group enhances the compound's lipophilicity and can influence its biological activity, making it of interest in medicinal chemistry and agrochemical applications. Additionally, the presence of the fluorine atom can impart unique electronic properties, potentially affecting the compound's stability and reactivity. As with many fluorinated compounds, it may exhibit increased resistance to degradation, which can be advantageous in certain applications but also raises environmental considerations. Proper handling and safety measures are essential due to its potential toxicity and reactivity.
Formula:C8H3F4NS
InChI:InChI=1/C8H3F4NS/c9-6-2-1-5(8(10,11)12)3-7(6)13-4-14/h1-3H
SMILES:c1cc(c(cc1C(F)(F)F)N=C=S)F
Synonyms:
  • Benzene, 1-fluoro-2-isothiocyanato-4-(trifluoromethyl)-
  • 1-Fluoro-2-isothiocyanato-4-(trifluoromethyl)benzene
  • 2-FLUORO-5-TRIFLUOROMETHYLPHENYL ISOTHI&
  • 2-FLUORO-5-TRIFLUOROMETHYLPHENYL ISOTHIO
  • Benzene, 1-fluoro-2-isothiocyanato-4-(trifluoromethyl)- (9CI)
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