Cas no 59589-92-3 (1,1'-Biphenyl,3,4,4',5-tetrabromo-)

1,1'-Biphenyl,3,4,4',5-tetrabromo- structure
59589-92-3 structure
Product Name:1,1'-Biphenyl,3,4,4',5-tetrabromo-
CAS No:59589-92-3
MF:C12H6Br4
MW:469.792040348053
CID:367802
PubChem ID:154383
Update Time:2025-04-19

1,1'-Biphenyl,3,4,4',5-tetrabromo- Chemical and Physical Properties

Names and Identifiers

    • 1,1'-Biphenyl,3,4,4',5-tetrabromo-
    • 1,2,3-tribromo-5-(4-bromophenyl)benzene
    • 3,4,4',5-Tetrabromo-1,1'-biphenyl
    • NS00120498
    • 59589-92-3
    • M752Q2H58M
    • UNII-M752Q2H58M
    • 1,1'-Biphenyl, 3,4,4',5-tetrabromo-
    • Q27283582
    • 3,4,4',5-Tetrabromobiphenyl
    • DTXSID10208252
    • PBB 81
    • Inchi: 1S/C12H6Br4/c13-9-3-1-7(2-4-9)8-5-10(14)12(16)11(15)6-8/h1-6H
    • InChI Key: BQOPMOAYELIJRL-UHFFFAOYSA-N
    • SMILES: BrC1C(=C(C=C(C=1)C1C=CC(=CC=1)Br)Br)Br

Computed Properties

  • Exact Mass: 465.72018
  • Monoisotopic Mass: 465.72
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 1
  • Complexity: 213
  • 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: 6.3
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • Density: 2.14
  • Boiling Point: 427°C at 760 mmHg
  • Flash Point: 205°C
  • Refractive Index: 1.666
  • PSA: 0
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