Cas no 2138066-67-6 (4,4-Dimethyl-3-(2-methylpropyl)cyclohexan-1-one)

4,4-Dimethyl-3-(2-methylpropyl)cyclohexan-1-one structure
2138066-67-6 structure
Product Name:4,4-Dimethyl-3-(2-methylpropyl)cyclohexan-1-one
CAS No:2138066-67-6
MF:C12H22O
MW:182.302484035492
CID:5787385
PubChem ID:159400825
Update Time:2023-12-26

4,4-Dimethyl-3-(2-methylpropyl)cyclohexan-1-one Chemical and Physical Properties

Names and Identifiers

    • 2138066-67-6
    • EN300-1157011
    • 4,4-dimethyl-3-(2-methylpropyl)cyclohexan-1-one
    • 4,4-Dimethyl-3-(2-methylpropyl)cyclohexan-1-one
    • Inchi: 1S/C12H22O/c1-9(2)7-10-8-11(13)5-6-12(10,3)4/h9-10H,5-8H2,1-4H3
    • InChI Key: WUAIXOOYWUEGKA-UHFFFAOYSA-N
    • SMILES: O=C1CCC(C)(C)C(C1)CC(C)C

Computed Properties

  • Exact Mass: 182.167065321g/mol
  • Monoisotopic Mass: 182.167065321g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 191
  • 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: 3.4
  • Topological Polar Surface Area: 17.1?2

4,4-Dimethyl-3-(2-methylpropyl)cyclohexan-1-one Pricemore >>

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