Cas no 61177-58-0 (Ethanone, 1-bicyclo[5.1.0]oct-8-yl-)

Ethanone, 1-bicyclo[5.1.0]oct-8-yl- structure
61177-58-0 structure
Product Name:Ethanone, 1-bicyclo[5.1.0]oct-8-yl-
CAS No:61177-58-0
MF:C10H16O
MW:152.233443260193
CID:489529
PubChem ID:71398572
Update Time:2025-04-19

Ethanone, 1-bicyclo[5.1.0]oct-8-yl- Chemical and Physical Properties

Names and Identifiers

    • Ethanone, 1-bicyclo[5.1.0]oct-8-yl-
    • 1-(8-bicyclo[5.1.0]octanyl)ethanone
    • DTXSID80819990
    • 61177-58-0
    • 1-(Bicyclo[5.1.0]octan-8-yl)ethan-1-one
    • Inchi: 1S/C10H16O/c1-7(11)10-8-5-3-2-4-6-9(8)10/h8-10H,2-6H2,1H3
    • InChI Key: CXDOAUMSSAVJDJ-UHFFFAOYSA-N
    • SMILES: O=C(C)C1C2CCCCCC21

Computed Properties

  • Exact Mass: 152.12018
  • Monoisotopic Mass: 152.120115130g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 162
  • 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: 17.1?2

Experimental Properties

  • PSA: 17.07
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