ChemSpider 2D Image | 4-Propylphenyl 4-(trans-4-ethylcyclohexyl)benzoate | C24H30O2

4-Propylphenyl 4-(trans-4-ethylcyclohexyl)benzoate

  • Molecular FormulaC24H30O2
  • Average mass350.494 Da
  • Monoisotopic mass350.224579 Da
  • ChemSpider ID27471916

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

104633-43-4 [RN]
4-(trans-4-Éthylcyclohexyl)benzoate de 4-propylphényle [French] [ACD/IUPAC Name]
4-Propylphenyl 4-(trans-4-ethylcyclohexyl)benzoate [ACD/IUPAC Name]
4-Propylphenyl-4-(trans-4-ethylcyclohexyl)benzoat [German] [ACD/IUPAC Name]
Benzoic acid, 4-(trans-4-ethylcyclohexyl)-, 4-propylphenyl ester [ACD/Index Name]
4-n-Propylphenyl trans-4-(4-ethylcyclohexyl)benzoate
4-PROPYLPHENYL-4-(TRANS-4-ETHYLCYCLOHEXYL)BENZOATE
4-Propylphenyl-4-Trans-EthylcyclohexylBenzoate
MFCD09952982 [MDL number]
trans-4-(4-Ethylcyclohexyl)benzoic acid 4-n-propylphenyl ester

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 479.1±34.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 74.3±3.0 kJ/mol
    Flash Point: 202.8±23.1 °C
    Index of Refraction: 1.542
    Molar Refractivity: 107.3±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 1
    ACD/LogP: 8.66
    ACD/LogD (pH 5.5): 7.55
    ACD/BCF (pH 5.5): 319829.53
    ACD/KOC (pH 5.5): 303385.38
    ACD/LogD (pH 7.4): 7.55
    ACD/BCF (pH 7.4): 319829.53
    ACD/KOC (pH 7.4): 303385.38
    Polar Surface Area: 26 Å2
    Polarizability: 42.5±0.5 10-24cm3
    Surface Tension: 38.9±3.0 dyne/cm
    Molar Volume: 341.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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