Cas no 278-84-2 (3-Oxatricyclo[3.2.2.02,4]nonane)

3-Oxatricyclo[3.2.2.02,4]nonane structure
278-84-2 structure
Product Name:3-Oxatricyclo[3.2.2.02,4]nonane
CAS No:278-84-2
MF:C8H12O
MW:124.180282592773
CID:273958
PubChem ID:549357
Update Time:2025-04-19

3-Oxatricyclo[3.2.2.02,4]nonane Chemical and Physical Properties

Names and Identifiers

    • 3-Oxatricyclo[3.2.2.02,4]nonane
    • Bicyclo[2.2.2]octane,2,3-epoxy-
    • 278-84-2
    • Bicyclo[2.2.2]octane, 2,3-epoxy-
    • SCHEMBL9621061
    • 3-Oxatricyclo[3.2.2.0(2,4)]nonane
    • XYBMDMJEJFCMFT-UHFFFAOYSA-N
    • DTXSID30338489
    • Inchi: 1S/C8H12O/c1-2-6-4-3-5(1)7-8(6)9-7/h5-8H,1-4H2
    • InChI Key: XYBMDMJEJFCMFT-UHFFFAOYSA-N
    • SMILES: O1C2C3CCC(CC3)C12

Computed Properties

  • Exact Mass: 124.08886
  • Monoisotopic Mass: 124.088815002g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 0
  • Complexity: 120
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.5
  • Topological Polar Surface Area: 12.5?2

Experimental Properties

  • PSA: 12.53
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