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CAS 81613-61-8

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3-[3,5-bis(trifluoromethyl)phenyl]prop-2-yn-1-ol

Description:
3-[3,5-bis(trifluoromethyl)phenyl]prop-2-yn-1-ol, with the CAS number 81613-61-8, is an organic compound characterized by its unique structure that includes a propargyl alcohol functional group and a highly substituted aromatic ring. The presence of two trifluoromethyl groups on the phenyl ring significantly influences its chemical properties, enhancing its lipophilicity and potentially its reactivity. This compound is likely to exhibit strong hydrogen bonding capabilities due to the hydroxyl (-OH) group, which can also participate in various chemical reactions, such as nucleophilic substitutions or coupling reactions. The trifluoromethyl groups contribute to the compound's stability and can affect its electronic properties, making it useful in various applications, including pharmaceuticals and agrochemicals. Additionally, the compound may exhibit interesting physical properties, such as solubility in organic solvents and potential volatility, depending on the specific conditions. Overall, its unique structural features make it a subject of interest in synthetic organic chemistry and materials science.
Formula:C11H6F6O
InChI:InChI=1/C11H6F6O/c12-10(13,14)8-4-7(2-1-3-18)5-9(6-8)11(15,16)17/h4-6,18H,3H2
SMILES:C(#Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)CO
Synonyms:
  • 2-Propyn-1-ol, 3-[3,5-bis(trifluoromethyl)phenyl]-
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