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CAS 1349719-20-5

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3,3,3-Trifluoropropyl thiocyanate

Description:
3,3,3-Trifluoropropyl thiocyanate is an organofluorine compound characterized by the presence of a trifluoropropyl group and a thiocyanate functional group. Its molecular structure features a three-carbon chain where the terminal carbon is substituted with three fluorine atoms, enhancing its reactivity and polarity. The thiocyanate group (-SCN) contributes to its potential as a nucleophile in various chemical reactions. This compound is typically colorless to pale yellow and may have a distinct odor. It is soluble in polar solvents due to its polar functional groups, while its trifluoromethyl moiety can impart unique properties such as increased lipophilicity and thermal stability. 3,3,3-Trifluoropropyl thiocyanate may be used in specialized applications, including as a reagent in organic synthesis or in the development of pharmaceuticals. However, handling precautions are necessary due to its potential toxicity and environmental impact, as with many organofluorine compounds. Proper safety measures should be observed when working with this substance in laboratory or industrial settings.
Formula:C4H4F3NS
InChI:InChI=1S/C4H4F3NS/c5-4(6,7)1-2-9-3-8/h1-2H2
InChI key:InChIKey=ODVVIKUMHLKOAS-UHFFFAOYSA-N
SMILES:C(C(F)(F)F)CSC#N
Synonyms:
  • Thiocyanic acid, 3,3,3-trifluoropropyl ester
  • 3,3,3-Trifluoropropyl thiocyanate
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