Cas no 67525-36-4 (1,4-bis[4-(trifluoromethyl)phenoxy]benzene)

1,4-bis[4-(trifluoromethyl)phenoxy]benzene structure
67525-36-4 structure
Product Name:1,4-bis[4-(trifluoromethyl)phenoxy]benzene
CAS No:67525-36-4
MF:C20H12F6O2
MW:398.298506736755
CID:966203
PubChem ID:3017770
Update Time:2025-04-19

1,4-bis[4-(trifluoromethyl)phenoxy]benzene Chemical and Physical Properties

Names and Identifiers

    • 1,4-bis[4-(trifluoromethyl)phenoxy]benzene
    • 1,1'-[benzene-1,4-diylbis(oxy)]bis[4-(trifluoromethyl)benzene]
    • 1,4-Bis(4-(trifluoromethyl)phenoxy)benzene
    • 67525-36-4
    • SCHEMBL11148692
    • NS00056594
    • DBEALIZXNCCVBG-UHFFFAOYSA-N
    • DTXSID10986907
    • EINECS 266-712-0
    • 1,1'-[1,4-Phenylenebis(oxy)]bis[4-(trifluoromethyl)benzene]
    • Inchi: 1S/C20H12F6O2/c21-19(22,23)13-1-5-15(6-2-13)27-17-9-11-18(12-10-17)28-16-7-3-14(4-8-16)20(24,25)26/h1-12H
    • InChI Key: DBEALIZXNCCVBG-UHFFFAOYSA-N
    • SMILES: FC(C1C=CC(=CC=1)OC1C=CC(=CC=1)OC1C=CC(C(F)(F)F)=CC=1)(F)F

Computed Properties

  • Exact Mass: 398.07416
  • Monoisotopic Mass: 398.074
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 28
  • Rotatable Bond Count: 4
  • Complexity: 424
  • 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: 6.7
  • Topological Polar Surface Area: 18.5?2

Experimental Properties

  • Density: 1.338
  • Boiling Point: 389°C at 760 mmHg
  • Flash Point: 197.7°C
  • Refractive Index: 1.51
  • PSA: 18.46
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