Cas no 6712-71-6 (3-Cyclohexen-1-one, 3-methyl-6-(1-methylethylidene)-)

3-Cyclohexen-1-one, 3-methyl-6-(1-methylethylidene)- structure
6712-71-6 structure
Product Name:3-Cyclohexen-1-one, 3-methyl-6-(1-methylethylidene)-
CAS No:6712-71-6
MF:C10H14O
MW:150.217563152313
CID:1714900
PubChem ID:85949503
Update Time:2025-04-21

3-Cyclohexen-1-one, 3-methyl-6-(1-methylethylidene)- Chemical and Physical Properties

Names and Identifiers

    • 3-Cyclohexen-1-one, 3-methyl-6-(1-methylethylidene)-
    • 3-Methyl-6-(propan-2-ylidene)cyclohex-3-en-1-one
    • 6712-71-6
    • Inchi: 1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4H,5-6H2,1-3H3
    • InChI Key: KKYWREYWOHOUSP-UHFFFAOYSA-N
    • SMILES: O=C1CC(C)=CC/C/1=C(/C)\C

Computed Properties

  • Exact Mass: 150.10452
  • Monoisotopic Mass: 150.104465066g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 240
  • 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: 2.2
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • PSA: 17.07
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