Cas no 90047-30-6 (2-Aceanthrylenol, 1,2-dihydro-)

2-Aceanthrylenol, 1,2-dihydro- structure
90047-30-6 structure
Product Name:2-Aceanthrylenol, 1,2-dihydro-
CAS No:90047-30-6
MF:C16H12O
MW:220.265884399414
CID:795542
PubChem ID:13262722
Update Time:2025-04-19

2-Aceanthrylenol, 1,2-dihydro- Chemical and Physical Properties

Names and Identifiers

    • 2-Aceanthrylenol, 1,2-dihydro-
    • 1,2-dihydroaceanthrylen-2-ol
    • DTXSID80532859
    • 90047-30-6
    • Inchi: 1S/C16H12O/c17-15-9-14-12-6-2-1-4-10(12)8-11-5-3-7-13(15)16(11)14/h1-8,15,17H,9H2
    • InChI Key: IJVHBLPVEXXSPD-UHFFFAOYSA-N
    • SMILES: OC1C2=CC=CC3=CC4C=CC=CC=4C(C1)=C23

Computed Properties

  • Exact Mass: 220.088815002g/mol
  • Monoisotopic Mass: 220.088815002g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 0
  • Complexity: 300
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.6
  • Topological Polar Surface Area: 20.2?2
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