Cas no 84249-62-7 (3-Chrysenol,5,11-dimethyl-)

3-Chrysenol,5,11-dimethyl- structure
3-Chrysenol,5,11-dimethyl- structure
Product Name:3-Chrysenol,5,11-dimethyl-
CAS No:84249-62-7
MF:C20H16O
MW:272.340445518494
CID:730615
PubChem ID:187411
Update Time:2025-04-19

3-Chrysenol,5,11-dimethyl- Chemical and Physical Properties

Names and Identifiers

    • 3-Chrysenol,5,11-dimethyl-
    • 5,11-dimethylchrysen-3-ol
    • 3-Chrysenol, 5,11-dimethyl-
    • DTXSID001004497
    • 84249-62-7
    • Inchi: 1S/C20H16O/c1-12-10-15-7-8-16(21)11-18(15)20-13(2)9-14-5-3-4-6-17(14)19(12)20/h3-11,21H,1-2H3
    • InChI Key: KWSQHZOXKXWDNI-UHFFFAOYSA-N
    • SMILES: OC1C=CC2=CC(C)=C3C4C=CC=CC=4C=C(C)C3=C2C=1

Computed Properties

  • Exact Mass: 272.120115130g/mol
  • Monoisotopic Mass: 272.120115130g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 0
  • Complexity: 378
  • 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
  • Topological Polar Surface Area: 20.2?2
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