ChemSpider 2D Image | 3,3-Dimethylcyclobutanol | C6H12O

3,3-Dimethylcyclobutanol

  • Molecular FormulaC6H12O
  • Average mass100.159 Da
  • Monoisotopic mass100.088814 Da
  • ChemSpider ID34216027

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

3,3-Dimethylcyclobutanol [German] [ACD/IUPAC Name]
3,3-Dimethylcyclobutanol [ACD/IUPAC Name]
3,3-Diméthylcyclobutanol [French] [ACD/IUPAC Name]
Cyclobutanol, 3,3-dimethyl- [ACD/Index Name]
3,3-dimethylcyclobutan-1-ol
54166-17-5 [RN]
CC1(C)CC(O)C1
MFCD11878436

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 0.9±0.1 g/cm3
    Boiling Point: 125.2±8.0 °C at 760 mmHg
    Vapour Pressure: 5.7±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 42.3±6.0 kJ/mol
    Flash Point: 41.2±10.9 °C
    Index of Refraction: 1.464
    Molar Refractivity: 29.4±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 1.25
    ACD/LogD (pH 5.5): 1.24
    ACD/BCF (pH 5.5): 5.12
    ACD/KOC (pH 5.5): 112.03
    ACD/LogD (pH 7.4): 1.24
    ACD/BCF (pH 7.4): 5.12
    ACD/KOC (pH 7.4): 112.03
    Polar Surface Area: 20 Å2
    Polarizability: 11.6±0.5 10-24cm3
    Surface Tension: 30.5±3.0 dyne/cm
    Molar Volume: 106.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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