ChemSpider 2D Image | Dimethyl 5,5-difluoro-1,3-cyclohexanedicarboxylate | C10H14F2O4

Dimethyl 5,5-difluoro-1,3-cyclohexanedicarboxylate

  • Molecular FormulaC10H14F2O4
  • Average mass236.213 Da
  • Monoisotopic mass236.086014 Da
  • ChemSpider ID29211724

More details:

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

1,3-Cyclohexanedicarboxylic acid, 5,5-difluoro-, dimethyl ester [ACD/Index Name]
5,5-Difluoro-1,3-cyclohexanedicarboxylate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 5,5-difluoro-1,3-cyclohexanedicarboxylate [ACD/IUPAC Name]
Dimethyl-5,5-difluor-1,3-cyclohexandicarboxylat [German] [ACD/IUPAC Name]
1296114-57-2 [RN]
Dimethyl 5,5-difluorocyclohexane-1,3-dicarboxylate
Dimethyl5,5-difluorocyclohexane-1,3-dicarboxylate
MFCD26406253

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 262.4±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 50.0±3.0 kJ/mol
    Flash Point: 109.1±22.2 °C
    Index of Refraction: 1.431
    Molar Refractivity: 50.2±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 0.83
    ACD/LogD (pH 5.5): 1.24
    ACD/BCF (pH 5.5): 5.17
    ACD/KOC (pH 5.5): 112.88
    ACD/LogD (pH 7.4): 1.24
    ACD/BCF (pH 7.4): 5.17
    ACD/KOC (pH 7.4): 112.88
    Polar Surface Area: 53 Å2
    Polarizability: 19.9±0.5 10-24cm3
    Surface Tension: 32.3±5.0 dyne/cm
    Molar Volume: 194.0±5.0 cm3

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