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CAS 845781-04-6

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(4-Butylphenyl)(3,4-difluorophenyl)methanone

Description:
(4-Butylphenyl)(3,4-difluorophenyl)methanone, identified by its CAS number 845781-04-6, is an organic compound characterized by its ketone functional group, which is central to its structure. This compound features a butyl group attached to a phenyl ring, providing hydrophobic characteristics, while the presence of the difluorophenyl moiety introduces electronegative fluorine atoms that can influence its reactivity and polarity. The molecular structure suggests potential applications in various fields, including pharmaceuticals and materials science, due to its unique electronic properties and steric effects. The presence of fluorine atoms often enhances the compound's stability and lipophilicity, which can be advantageous in drug design. Additionally, the compound's physical properties, such as melting point, boiling point, and solubility, would be influenced by the size and nature of the substituents on the phenyl rings. Overall, this compound exemplifies the complexity and versatility of organic molecules in chemical synthesis and application.
Formula:C17H16F2O
InChI:InChI=1S/C17H16F2O/c1-2-3-4-12-5-7-13(8-6-12)17(20)14-9-10-15(18)16(19)11-14/h5-11H,2-4H2,1H3
InChI key:InChIKey=PRQKSSOAHRWKSW-UHFFFAOYSA-N
SMILES:C(=O)(C1=CC(F)=C(F)C=C1)C2=CC=C(CCCC)C=C2
Synonyms:
  • Methanone, (4-butylphenyl)(3,4-difluorophenyl)-
  • (4-Butylphenyl)(3,4-difluorophenyl)methanone
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