Cas no 52209-72-0 (8-Oxabicyclo[5.1.0]octane, 1,5,5-trimethyl-)

8-Oxabicyclo[5.1.0]octane, 1,5,5-trimethyl- structure
52209-72-0 structure
Product Name:8-Oxabicyclo[5.1.0]octane, 1,5,5-trimethyl-
CAS No:52209-72-0
MF:C10H18O
MW:154.249323368073
CID:360171
PubChem ID:13679853
Update Time:2025-04-19

8-Oxabicyclo[5.1.0]octane, 1,5,5-trimethyl- Chemical and Physical Properties

Names and Identifiers

    • 8-Oxabicyclo[5.1.0]octane, 1,5,5-trimethyl-
    • 3,3,7-trimethyl-8-oxabicyclo[5.1.0]octane
    • 52209-72-0
    • 1,5,5-trimethyl-8-oxabicyclo-[5.1.0]octane
    • 1,5,5-Trimethyl-8-oxabicyclo[5.1.0]octane
    • DTXSID30546542
    • Inchi: 1S/C10H18O/c1-9(2)5-4-6-10(3)8(7-9)11-10/h8H,4-7H2,1-3H3
    • InChI Key: DLKQMVFNHSQJPX-UHFFFAOYSA-N
    • SMILES: O1C2CC(C)(C)CCCC12C

Computed Properties

  • Exact Mass: 154.13584
  • Monoisotopic Mass: 154.135765193g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 174
  • 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: 2.7
  • Topological Polar Surface Area: 12.5?2

Experimental Properties

  • PSA: 12.53
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