Cas no 223480-81-7 (7-Oxabicyclo[4.1.0]heptane,2-ethyl-)

7-Oxabicyclo[4.1.0]heptane,2-ethyl- structure
223480-81-7 structure
Product Name:7-Oxabicyclo[4.1.0]heptane,2-ethyl-
CAS No:223480-81-7
MF:C8H14O
MW:126.196162700653
CID:244542
PubChem ID:22924927
Update Time:2025-04-19

7-Oxabicyclo[4.1.0]heptane,2-ethyl- Chemical and Physical Properties

Names and Identifiers

    • 7-Oxabicyclo[4.1.0]heptane,2-ethyl-
    • DTXSID101295376
    • SCHEMBL723707
    • 2-Ethyl-7-oxabicyclo[4.1.0]heptane
    • 223480-81-7
    • Inchi: 1S/C8H14O/c1-2-6-4-3-5-7-8(6)9-7/h6-8H,2-5H2,1H3
    • InChI Key: HEHBHCRLIYBRAN-UHFFFAOYSA-N
    • SMILES: O1C2CCCC(CC)C12

Computed Properties

  • Exact Mass: 126.10452
  • Monoisotopic Mass: 126.104465066g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 1
  • Complexity: 111
  • 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
  • Topological Polar Surface Area: 12.5?2

Experimental Properties

  • PSA: 12.53
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