Cas no 567-81-7 (1,1'-Biphenyl,2,2'-difluoro-3,3',5,5'-tetramethyl-4,4',6,6'-tetranitro-)

1,1'-Biphenyl,2,2'-difluoro-3,3',5,5'-tetramethyl-4,4',6,6'-tetranitro- structure
567-81-7 structure
Product Name:1,1'-Biphenyl,2,2'-difluoro-3,3',5,5'-tetramethyl-4,4',6,6'-tetranitro-
CAS No:567-81-7
MF:C16H12F2N4O8
MW:426.285290718079
CID:380023
PubChem ID:292971
Update Time:2025-04-19

1,1'-Biphenyl,2,2'-difluoro-3,3',5,5'-tetramethyl-4,4',6,6'-tetranitro- Chemical and Physical Properties

Names and Identifiers

    • 1,1'-Biphenyl,2,2'-difluoro-3,3',5,5'-tetramethyl-4,4',6,6'-tetranitro-
    • 1-fluoro-2-(2-fluoro-3,5-dimethyl-4,6-dinitrophenyl)-4,6-dimethyl-3,5-dinitrobenzene
    • 2,2'-Difluor-3,5,3',5'-tetramethyl-4,6,4',6'-tetranitro-biphenyl
    • 2,2'-difluoro-3,3',5,5'-tetramethyl-4,4',6,6'-tetranitrobiphenyl
    • 2,2'-difluoro-3,5,3',5'-tetramethyl-4,6,4',6'-tetranitro-biphenyl
    • AC1L6J5I
    • AC1Q4N44
    • AG-J-70881
    • AR-1D1396
    • CTK5A5700
    • NSC159246
    • DTXSID10303594
    • NSC-159246
    • 567-81-7
    • Inchi: 1S/C16H12F2N4O8/c1-5-11(17)9(15(21(27)28)7(3)13(5)19(23)24)10-12(18)6(2)14(20(25)26)8(4)16(10)22(29)30/h1-4H3
    • InChI Key: MYODFJUODZLJDM-UHFFFAOYSA-N
    • SMILES: FC1=C(C)C(=C(C)C(=C1C1C(=C(C)C(=C(C)C=1[N+](=O)[O-])[N+](=O)[O-])F)[N+](=O)[O-])[N+](=O)[O-]

Computed Properties

  • Exact Mass: 426.06236
  • Monoisotopic Mass: 426.062
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 10
  • Heavy Atom Count: 30
  • Rotatable Bond Count: 1
  • Complexity: 660
  • 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: 4.5
  • Topological Polar Surface Area: 183?2

Experimental Properties

  • Density: 1.546
  • Boiling Point: 478.5°C at 760 mmHg
  • Flash Point: 243.2°C
  • Refractive Index: 1.616
  • PSA: 172.56
  • LogP: 6.59100
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