Cas no 7328-07-6 (3-Cyclohexene-1,1-dimethanol,6-methyl-)

3-Cyclohexene-1,1-dimethanol,6-methyl- structure
7328-07-6 structure
Product Name:3-Cyclohexene-1,1-dimethanol,6-methyl-
CAS No:7328-07-6
MF:C9H16O2
MW:156.222143173218
CID:576279
PubChem ID:138997
Update Time:2025-04-19

3-Cyclohexene-1,1-dimethanol,6-methyl- Chemical and Physical Properties

Names and Identifiers

    • 3-Cyclohexene-1,1-dimethanol,6-methyl-
    • 3-Cyclohexene-1,1-dimethanol, 6-methyl-; 3-Cyclohexene-1,1-dimethanol, 6-methyl-,
    • 6-methyl-3-cyclohexene-1,1-dimethanol
    • AKOS024332503
    • NSC97532
    • NSC 97532
    • 3-Cyclohexene-1,1-dimethanol, 6-methyl-,
    • SCHEMBL5598637
    • OTRKULZGGPEGEA-UHFFFAOYSA-N
    • 3-Cyclohexene-1,1-dimethanol, 6-methyl-
    • NSC-97532
    • SMR001570118
    • MLS002703399
    • 7328-07-6
    • Inchi: 1S/C9H16O2/c1-8-4-2-3-5-9(8,6-10)7-11/h2-3,8,10-11H,4-7H2,1H3
    • InChI Key: OTRKULZGGPEGEA-UHFFFAOYSA-N
    • SMILES: OCC1(CO)CC=CCC1C

Computed Properties

  • Exact Mass: 156.11508
  • Monoisotopic Mass: 156.115
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 148
  • 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: 0.9
  • Topological Polar Surface Area: 40.5?2

Experimental Properties

  • Density: 1.005
  • Boiling Point: 240.4°C at 760 mmHg
  • Flash Point: 107.6°C
  • Refractive Index: 1.482
  • PSA: 40.46
  • LogP: 0.94350
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