Cas no 68217-19-6 (3,6-ethanodicyclopenta[cd,gh]pentalene-7,8-dione,dodecahydro-)

3,6-ethanodicyclopenta[cd,gh]pentalene-7,8-dione,dodecahydro- structure
68217-19-6 structure
Product Name:3,6-ethanodicyclopenta[cd,gh]pentalene-7,8-dione,dodecahydro-
CAS No:68217-19-6
MF:C14H16O2
MW:216.275644302368
CID:863111
PubChem ID:144291
Update Time:2025-04-19

3,6-ethanodicyclopenta[cd,gh]pentalene-7,8-dione,dodecahydro- Chemical and Physical Properties

Names and Identifiers

    • 3,6-ethanodicyclopenta[cd,gh]pentalene-7,8-dione,dodecahydro-
    • 3,6-Ethanodicyclopenta(cd,gh)pentalene-7,8-dione, dodecahydro-
    • AC1L3OWL
    • 68217-19-6
    • Dodecahydro-3,6-ethanodicyclopenta[cd,gh]pentalene-7,8-dione
    • DTXSID20987728
    • AKOS024330081
    • RCL T201340
    • Inchi: 1S/C14H16O2/c15-13-11-5-1-2-6-9(5)10-7(11)3-4-8(10)12(6)14(13)16/h5-12H,1-4H2
    • InChI Key: KFPQILVZXPVTDW-UHFFFAOYSA-N
    • SMILES: O=C1C(C2C3CCC4C1C1CCC2C1C43)=O

Computed Properties

  • Exact Mass: 216.115029749g/mol
  • Monoisotopic Mass: 216.115029749g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 0
  • Complexity: 363
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 4
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.1
  • Topological Polar Surface Area: 34.1?2
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