Cas no 17135-49-8 (1-Butanone,1,4-bis(4-fluorophenyl)-)

1-Butanone,1,4-bis(4-fluorophenyl)- structure
17135-49-8 structure
Product Name:1-Butanone,1,4-bis(4-fluorophenyl)-
CAS No:17135-49-8
MF:C16H14F2O
MW:260.278571605682
CID:198496
PubChem ID:86964
Update Time:2025-04-19

1-Butanone,1,4-bis(4-fluorophenyl)- Chemical and Physical Properties

Names and Identifiers

    • 1-Butanone,1,4-bis(4-fluorophenyl)-
    • 1,4-bis(4-fluorophenyl)butan-1-one
    • 4'-fluoro-4-(4-fluorophenyl)butyrophenone
    • 1,4-Bis(4-fluorophenyl)-1-butanone
    • 4/'-fluoro-4-(4-fluorophenyl)butyrophenone
    • DTXSID60169066
    • EINECS 241-193-3
    • 17135-49-8
    • NS00054172
    • SCHEMBL11017525
    • Inchi: 1S/C16H14F2O/c17-14-8-4-12(5-9-14)2-1-3-16(19)13-6-10-15(18)11-7-13/h4-11H,1-3H2
    • InChI Key: MWVYAXLUWZOOLT-UHFFFAOYSA-N
    • SMILES: FC1C=CC(=CC=1)CCCC(C1C=CC(=CC=1)F)=O

Computed Properties

  • Exact Mass: 260.10132
  • Monoisotopic Mass: 260.101
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 5
  • Complexity: 277
  • 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: 4.1
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • Density: 1.166
  • Boiling Point: 375.5°Cat760mmHg
  • Flash Point: 143.4°C
  • Refractive Index: 1.54
  • PSA: 17.07

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