Cas no 80254-79-1 (1,1'-Biphenyl, 3-chloro-4'-fluoro-)

1,1'-Biphenyl, 3-chloro-4'-fluoro- structure
80254-79-1 structure
Product Name:1,1'-Biphenyl, 3-chloro-4'-fluoro-
CAS No:80254-79-1
MF:C12H8ClF
MW:206.643325805664
CID:705998
PubChem ID:2757546
Update Time:2025-04-19

1,1'-Biphenyl, 3-chloro-4'-fluoro- Chemical and Physical Properties

Names and Identifiers

    • 1,1'-Biphenyl, 3-chloro-4'-fluoro-
    • 1-chloro-3-(4-fluorophenyl)benzene
    • 80254-79-1
    • DTXSID10373939
    • Inchi: 1S/C12H8ClF/c13-11-3-1-2-10(8-11)9-4-6-12(14)7-5-9/h1-8H
    • InChI Key: WCKTVTBPFMCTRT-UHFFFAOYSA-N
    • SMILES: ClC1=CC=CC(=C1)C1C=CC(=CC=1)F

Computed Properties

  • Exact Mass: 206.0298561g/mol
  • Monoisotopic Mass: 206.0298561g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 175
  • 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: 4.7
  • Topological Polar Surface Area: 0?2
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