Cas no 2568-14-1 (Bicyclo[3.3.1]nonan-2-ol)

Bicyclo[3.3.1]nonan-2-ol structure
Bicyclo[3.3.1]nonan-2-ol structure
Product Name:Bicyclo[3.3.1]nonan-2-ol
CAS No:2568-14-1
MF:C9H16O
MW:140.222743034363
CID:238438
PubChem ID:557157
Update Time:2025-04-19

Bicyclo[3.3.1]nonan-2-ol Chemical and Physical Properties

Names and Identifiers

    • Bicyclo[3.3.1]nonan-2-ol
    • bicyclo[3.3.1]nonan-4-ol
    • DTXSID50339594
    • SCHEMBL2477741
    • 2568-14-1
    • endo-bicyclo [3.3.1]nonan-8-ol
    • LPHKHFHEUORJNL-UHFFFAOYSA-N
    • Inchi： 1S/C9H16O/c10-9-5-4-7-2-1-3-8(9)6-7/h7-10H,1-6H2
    • InChI Key： LPHKHFHEUORJNL-UHFFFAOYSA-N
    • SMILES： OC1CCC2CCCC1C2

Computed Properties

  • Exact Mass: 140.12018
  • Monoisotopic Mass: 140.120115130g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 122
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 3
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.2
  • Topological Polar Surface Area: 20.2?2

Experimental Properties

  • PSA: 20.23

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