Cas no 89012-53-3 (Cyclopentanone, 3-ethyl-3-phenyl-)

Cyclopentanone, 3-ethyl-3-phenyl- structure
89012-53-3 structure
Product Name:Cyclopentanone, 3-ethyl-3-phenyl-
CAS No:89012-53-3
MF:C13H16O
MW:188.265543937683
CID:615925
PubChem ID:13411506
Update Time:2025-04-19

Cyclopentanone, 3-ethyl-3-phenyl- Chemical and Physical Properties

Names and Identifiers

    • Cyclopentanone, 3-ethyl-3-phenyl-
    • 3-ethyl-3-phenylcyclopentan-1-one
    • DTXSID20539943
    • 89012-53-3
    • Inchi: 1S/C13H16O/c1-2-13(9-8-12(14)10-13)11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3
    • InChI Key: QKWAMOBOGHMDJB-UHFFFAOYSA-N
    • SMILES: O=C1CCC(C2C=CC=CC=2)(CC)C1

Computed Properties

  • Exact Mass: 188.120115130g/mol
  • Monoisotopic Mass: 188.120115130g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 215
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.9
  • Topological Polar Surface Area: 17.1?2

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