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CAS 1813-97-4

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1-Allyl-4-(trifluoromethyl)benzene

Description:
1-Allyl-4-(trifluoromethyl)benzene, with the CAS number 1813-97-4, is an organic compound characterized by its aromatic structure, which includes a benzene ring substituted with both an allyl group and a trifluoromethyl group. The presence of the trifluoromethyl group (-CF3) significantly influences the compound's chemical properties, enhancing its lipophilicity and stability while also affecting its reactivity. The allyl group (-CH2-CH=CH2) introduces a site for potential reactions, making the compound useful in various synthetic applications. This compound is typically a colorless to pale yellow liquid with a distinctive odor. It is relatively non-polar due to the aromatic system and the bulky trifluoromethyl group, which can impact its solubility in different solvents. Additionally, 1-Allyl-4-(trifluoromethyl)benzene may exhibit interesting electronic properties due to the electron-withdrawing nature of the trifluoromethyl group, which can influence its behavior in electrophilic aromatic substitution reactions. Safety data should be consulted for handling and storage, as with all chemical substances.
Formula:C10H9F3
InChI:InChI=1S/C10H9F3/c1-2-3-8-4-6-9(7-5-8)10(11,12)13/h2,4-7H,1,3H2
InChI key:InChIKey=AEVBWCOLYXWNMX-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C1=CC=C(CC=C)C=C1
Synonyms:
  • Toluene, p-allyl-α,α,α-trifluoro-
  • 4-Allylbenzotrifluoride
  • 1-(2-Propen-1-yl)-4-(trifluoromethyl)benzene
  • Benzene, 1-(2-propen-1-yl)-4-(trifluoromethyl)-
  • Benzene, 1-(2-propenyl)-4-(trifluoromethyl)-
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