Cas no 113058-39-2 (Benzo[b]triphenylen-4-ol)

Benzo[b]triphenylen-4-ol structure
Benzo[b]triphenylen-4-ol structure
Product Name:Benzo[b]triphenylen-4-ol
CAS No:113058-39-2
MF:C22H14O
MW:294.345965862274
CID:214106
PubChem ID:154181
Update Time:2025-04-19

Benzo[b]triphenylen-4-ol Chemical and Physical Properties

Names and Identifiers

    • Benzo[b]triphenylen-4-ol
    • benzo[h]triphenylen-4-ol
    • Benzo[f]tetraphen-4-ol
    • UNII-803KRM9Y6L
    • 113058-39-2
    • BRN 4476422
    • 4-Hydroxydibenz(a,c)anthracene
    • 803KRM9Y6L
    • Benzo(b)triphenylen-4-ol
    • DIBENZ(A,C)ANTHRACEN-4-OL
    • DTXSID60150277
    • CCRIS 3838
    • 4-HYDROXYDIBENZ[A,C]ANTHRACENE
    • Inchi: 1S/C22H14O/c23-21-11-5-10-18-20-13-15-7-2-1-6-14(15)12-19(20)16-8-3-4-9-17(16)22(18)21/h1-13,23H
    • InChI Key: WKACBUXBZNZZLC-UHFFFAOYSA-N
    • SMILES: OC1=CC=CC2=C1C1C=CC=CC=1C1=CC3C=CC=CC=3C=C12

Computed Properties

  • Exact Mass: 294.10452
  • Monoisotopic Mass: 294.104465066g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 0
  • Complexity: 432
  • 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: 6.6
  • Topological Polar Surface Area: 20.2?2

Experimental Properties

  • PSA: 20.23
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