Cas no 161194-40-7 (Cyclohexanone, 4-dodecyl-)

Cyclohexanone, 4-dodecyl- structure
Cyclohexanone, 4-dodecyl- structure
Product Name:Cyclohexanone, 4-dodecyl-
CAS No:161194-40-7
MF:C18H34O
MW:266.46196603775
CID:1340513
PubChem ID:566175
Update Time:2025-04-20

Cyclohexanone, 4-dodecyl- Chemical and Physical Properties

Names and Identifiers

    • Cyclohexanone, 4-dodecyl-
    • 4-dodecylcyclohexan-1-one
    • 161194-40-7
    • DTXSID30340628
    • 4-Dodecylcyclohexanone
    • SCHEMBL11082717
    • AKOS021584671
    • KWKVXXLKBRCPLR-UHFFFAOYSA-N
    • Inchi: 1S/C18H34O/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(19)16-14-17/h17H,2-16H2,1H3
    • InChI Key: KWKVXXLKBRCPLR-UHFFFAOYSA-N
    • SMILES: O=C1CCC(CC1)CCCCCCCCCCCC

Computed Properties

  • Exact Mass: 266.26112
  • Monoisotopic Mass: 266.260965704g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 11
  • Complexity: 212
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 7.1
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • PSA: 17.07
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