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CAS 55579-73-2

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5-[2-(Trifluoromethyl)phenyl]-1,3-cyclohexanedione

Description:
5-[2-(Trifluoromethyl)phenyl]-1,3-cyclohexanedione, identified by its CAS number 55579-73-2, is an organic compound characterized by its unique structural features. It contains a cyclohexanedione core, which is a six-membered carbon ring with two ketone functional groups at the 1 and 3 positions. The presence of a trifluoromethyl group attached to a phenyl ring significantly influences its chemical properties, enhancing its lipophilicity and potentially its reactivity. This compound may exhibit interesting biological activities due to its structural motifs, making it of interest in medicinal chemistry and material science. Its fluorinated substituent can also impart unique electronic properties, affecting its interaction with other molecules. In terms of physical properties, it is likely to be a solid at room temperature, with solubility varying based on the solvent used. Safety data should be consulted for handling, as fluorinated compounds can have specific environmental and health considerations. Overall, this compound represents a fascinating example of how structural modifications can lead to diverse chemical behaviors and applications.
Formula:C13H11F3O2
InChI:InChI=1S/C13H11F3O2/c14-13(15,16)12-4-2-1-3-11(12)8-5-9(17)7-10(18)6-8/h1-4,8H,5-7H2
InChI key:InChIKey=YRXUINZCBBZSLH-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C1=C(C=CC=C1)C2CC(=O)CC(=O)C2
Synonyms:
  • 1,3-Cyclohexanedione, 5-[2-(trifluoromethyl)phenyl]-
  • 1,3-Cyclohexanedione, 5-[2-trifluoromethylphenyl]-
  • 5-[2-(Trifluoromethyl)phenyl]-1,3-cyclohexanedione
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