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CAS 705-31-7

:

4-Ethynyl-alpha,alpha,alpha-trifluorotoluene

Description:
4-Ethynyl-alpha,alpha,alpha-trifluorotoluene, with the CAS number 705-31-7, is an organic compound characterized by its unique trifluoromethyl and ethynyl functional groups. This compound features a toluene backbone, which is a benzene ring with a methyl group, substituted at the para position with an ethynyl group (–C≡C–) and at the alpha position with three fluorine atoms. The presence of the trifluoromethyl group significantly influences its chemical properties, enhancing its stability and lipophilicity, while also affecting its reactivity. This compound is typically used in organic synthesis and may serve as an intermediate in the production of various fluorinated compounds. Its physical properties, such as boiling point and solubility, can vary based on the molecular structure and the presence of the ethynyl and trifluoromethyl groups. Safety data indicates that, like many fluorinated compounds, it should be handled with care due to potential toxicity and environmental concerns. Overall, 4-Ethynyl-alpha,alpha,alpha-trifluorotoluene is a valuable compound in the field of synthetic organic chemistry.
Formula:C9H5F3
InChI:InChI=1/C9H5F3/c1-2-7-3-5-8(6-4-7)9(10,11)12/h1,3-6H
SMILES:C#Cc1ccc(cc1)C(F)(F)F
Synonyms:
  • 4-(Trifluoromethyl)phenylacetylene
  • 1-Ethynyl-4-(Trifluoromethyl)Benzene
  • 4'-Trifluoromethylphenyl acetylene
  • 4-Ethynyl-α,α,α-trifluorotoluene
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