Cas no 42794-87-6 (Benzidine, 3,3',5,5'-tetrafluoro-)

Benzidine, 3,3',5,5'-tetrafluoro- structure
42794-87-6 structure
Product Name:Benzidine, 3,3',5,5'-tetrafluoro-
CAS No:42794-87-6
MF:C12H8F4N2
MW:256.198936462402
CID:2655352
PubChem ID:148458
Update Time:2025-04-21

Benzidine, 3,3',5,5'-tetrafluoro- Chemical and Physical Properties

Names and Identifiers

    • 4-(4-amino-3,5-difluorophenyl)-2,6-difluoroaniline
    • (1,1'-Biphenyl)-4,4'-diamine, 3,3',5,5'-tetrafluoro-(9CI)
    • DTXSID30195478
    • [1,1'-Biphenyl]-4,4'-diamine, 3,3',5,5'-tetrafluoro-
    • BRN 2864699
    • 3,3',5,5'-Tetrafluoro-(1,1'-biphenyl)-4,4'-diamine
    • 82V8SZ5E3Q
    • SCHEMBL9001391
    • (1,1'-Biphenyl)-4,4'-diamine, 3,3',5,5'-tetrafluoro-
    • DTXCID40117969
    • Tetrafluorobenzidine, 3,3',5,5'
    • 3,3',5,5'-Tetrafluoro[1,1'-biphenyl]-4,4'-diamine
    • CCRIS 1278
    • 3,3',5,5'-Tetrafluorobenzidine
    • Benzidine, 3,3',5,5'-tetrafluoro-
    • 42794-87-6
    • Inchi: 1S/C12H8F4N2/c13-7-1-5(2-8(14)11(7)17)6-3-9(15)12(18)10(16)4-6/h1-4H,17-18H2
    • InChI Key: FHDAHNBPYOFJMC-UHFFFAOYSA-N
    • SMILES: FC1C(=C(C=C(C=1)C1C=C(C(=C(C=1)F)N)F)F)N

Computed Properties

  • Exact Mass: 256.062361
  • Monoisotopic Mass: 256.062361
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 1
  • Complexity: 239
  • 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
  • Topological Polar Surface Area: 52
  • XLogP3: 2.6

Experimental Properties

  • Density: 1.454
  • Boiling Point: 303.4°C at 760 mmHg
  • Flash Point: 136.5°C
  • Refractive Index: 1.588
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