ChemSpider 2D Image | 3-Propylcyclobutanone | C7H12O

3-Propylcyclobutanone

  • Molecular FormulaC7H12O
  • Average mass112.170 Da
  • Monoisotopic mass112.088814 Da
  • ChemSpider ID30800261

More details:






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

3-Propylcyclobutanon [German] [ACD/IUPAC Name]
3-Propylcyclobutanone [ACD/IUPAC Name]
3-Propylcyclobutanone [French] [ACD/IUPAC Name]
Cyclobutanone, 3-propyl- [ACD/Index Name]
3-propylcyclobutan-1-one
570410-05-8 [RN]
MFCD23884027

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

    Density: 0.9±0.1 g/cm3
    Boiling Point: 160.5±8.0 °C at 760 mmHg
    Vapour Pressure: 2.4±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 39.7±3.0 kJ/mol
    Flash Point: 44.0±10.7 °C
    Index of Refraction: 1.448
    Molar Refractivity: 32.5±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.19
    ACD/LogD (pH 5.5): 1.44
    ACD/BCF (pH 5.5): 7.34
    ACD/KOC (pH 5.5): 144.96
    ACD/LogD (pH 7.4): 1.44
    ACD/BCF (pH 7.4): 7.34
    ACD/KOC (pH 7.4): 144.96
    Polar Surface Area: 17 Å2
    Polarizability: 12.9±0.5 10-24cm3
    Surface Tension: 29.8±3.0 dyne/cm
    Molar Volume: 121.6±3.0 cm3

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