Cas no 97038-95-4 (1,1'-Biphenyl,2,2',4,6'-tetrabromo-)

1,1'-Biphenyl,2,2',4,6'-tetrabromo- structure
97038-95-4 structure
Product Name:1,1'-Biphenyl,2,2',4,6'-tetrabromo-
CAS No:97038-95-4
MF:C12H6Br4
MW:469.792040348053
CID:809930
PubChem ID:154509
Update Time:2025-04-19

1,1'-Biphenyl,2,2',4,6'-tetrabromo- Chemical and Physical Properties

Names and Identifiers

    • 1,1'-Biphenyl,2,2',4,6'-tetrabromo-
    • 1,3-dibromo-2-(2,4-dibromophenyl)benzene
    • 2,4-dibromo-1-(2,6-dibromophenyl)benzene
    • 2,2',4,6'-Tetrabromobiphenyl
    • Q660E25J4A
    • Q27287047
    • UNII-Q660E25J4A
    • PBB 51
    • 2,2',4,6'-Tetrabromo-1,1'-biphenyl
    • NS00121893
    • 1,1'-Biphenyl, 2,2',4,6'-tetrabromo-
    • 97038-95-4
    • DTXSID50242675
    • Inchi: 1S/C12H6Br4/c13-7-4-5-8(11(16)6-7)12-9(14)2-1-3-10(12)15/h1-6H
    • InChI Key: HFDOVSPQVPECFP-UHFFFAOYSA-N
    • SMILES: BrC1C=C(C=CC=1C1C(=CC=CC=1Br)Br)Br

Computed Properties

  • Exact Mass: 469.716
  • 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: 223
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 6.3
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • Density: 2.14
  • Boiling Point: 402.4°Cat760mmHg
  • Flash Point: 191°C
  • Refractive Index: 1.666

1,1'-Biphenyl,2,2',4,6'-tetrabromo- Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Butyllithium Solvents: Diethyl ether ,  Hexane ;  -78 °C; 30 min, -78 °C
1.2 Reagents: Methanol ;  -78 °C → rt
Reference
Catalytic asymmetric bromine-lithium exchange: a new tool to build axial chirality
Perron, Quentin; Alexakis, Alexandre, Advanced Synthesis & Catalysis, 2010, , 2611-2620

1,1'-Biphenyl,2,2',4,6'-tetrabromo- Raw materials

1,1'-Biphenyl,2,2',4,6'-tetrabromo- Preparation Products

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