Cas no 174485-41-7 (1,5-Bis(4-fluorophenyl)pentan-3-one)

1,5-Bis(4-fluorophenyl)pentan-3-one structure
174485-41-7 structure
Product Name:1,5-Bis(4-fluorophenyl)pentan-3-one
CAS No:174485-41-7
MF:C17H16F2O
MW:274.305151939392
CID:111720
PubChem ID:22114137
Update Time:2025-04-18

1,5-Bis(4-fluorophenyl)pentan-3-one Chemical and Physical Properties

Names and Identifiers

    • 1,5-Bis(4-fluorophenyl)pentan-3-one
    • 1,5-BIS-(4-FLUOROPHENYL)PENTAN-3-ONE,
    • 3-Pentanone,1,5-bis(4-fluorophenyl)-
    • 1,5-bis(4-fluorophenyl)-3-pentanone
    • 1,5-BIS(4-FLUORO-PHENYL)-PENTAN-3-ONE
    • 1,5-Bis-(4-fluorophenyl)-pentane-3-one
    • 3-Pentanone,1,5-bis(4-fluorophenyl)
    • 1,5-BIS-(4-FLUORO-PHENYL)-PENTAN-3-ONE
    • 3-Pentanone, 1,5-bis(4-fluorophenyl)-
    • A811643
    • DTXSID60622525
    • SCHEMBL7332325
    • 1,5-Bis-(4-fluorophenyl)pentan-3-one
    • 174485-41-7
    • C17H16F2O
    • Inchi: 1S/C17H16F2O/c18-15-7-1-13(2-8-15)5-11-17(20)12-6-14-3-9-16(19)10-4-14/h1-4,7-10H,5-6,11-12H2
    • InChI Key: FTKNDQZURBPRFH-UHFFFAOYSA-N
    • SMILES: FC1C=CC(=CC=1)CCC(CCC1C=CC(=CC=1)F)=O

Computed Properties

  • Exact Mass: 274.11700
  • Monoisotopic Mass: 274.11692145g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 6
  • Complexity: 261
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.9
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • PSA: 17.07000
  • LogP: 4.09930

1,5-Bis(4-fluorophenyl)pentan-3-one Related Literature

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