Cas no 69468-72-0 (Benzene, 1,1',1''-(cyclopentadienylmethylidyne)tris-)

Benzene, 1,1',1''-(cyclopentadienylmethylidyne)tris- structure
69468-72-0 structure
Product Name:Benzene, 1,1',1''-(cyclopentadienylmethylidyne)tris-
CAS No:69468-72-0
MF:C24H20
MW:308.415606498718
CID:391743
PubChem ID:632625
Update Time:2025-04-19

Benzene, 1,1',1''-(cyclopentadienylmethylidyne)tris- Chemical and Physical Properties

Names and Identifiers

    • Benzene, 1,1',1''-(cyclopentadienylmethylidyne)tris-
    • [cyclopenta-1,3-dien-1-yl(diphenyl)methyl]benzene
    • DTXSID20348219
    • Trityl-cyclopentadien
    • 69468-72-0
    • Inchi: 1S/C24H20/c1-4-12-20(13-5-1)24(23-18-10-11-19-23,21-14-6-2-7-15-21)22-16-8-3-9-17-22/h1-18H,19H2
    • InChI Key: XXFOPAGFXLYYFG-UHFFFAOYSA-N
    • SMILES: C(C1C=CC=CC=1)(C1C=CC=CC=1)(C1C=CC=CC=1)C1=CC=CC1

Computed Properties

  • Exact Mass: 308.1566
  • Monoisotopic Mass: 308.156500638g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 4
  • Complexity: 405
  • 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: 6.5
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • PSA: 0
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