ChemSpider 2D Image | trans-4'-Ethyl-[1,1'-bicyclohexyl]-4-one | C14H24O

trans-4'-Ethyl-[1,1'-bicyclohexyl]-4-one

  • Molecular FormulaC14H24O
  • Average mass208.340 Da
  • Monoisotopic mass208.182709 Da
  • ChemSpider ID26519659

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(trans)-4'-Ethyl-1,1'-bi(cyclohexyl)-4-on [German] [ACD/IUPAC Name]
(trans)-4'-Éthyl-1,1'-bi(cyclohexyl)-4-one [French] [ACD/IUPAC Name]
[1,1'-Bicyclohexyl]-4-one, 4'-ethyl-, trans- [ACD/Index Name]
150763-46-5 [RN]
485-460-4 [EINECS]
L6VTJ D- AL6TJ D2 &&trans Form [WLN]
trans-4'-Ethyl-[1,1'-bi(cyclohexan)]-4-one
trans-4'-Ethyl-[1,1'-bicyclohexyl]-4-one
(1'r,4'r)-4'-Ethyl-[1,1'-bi(cyclohexan)]-4-one [ACD/IUPAC Name]
(1'r,4'r)-4'-Ethyl-1,1'-bi(cyclohexyl)-4-on [German] [ACD/IUPAC Name]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 0.9±0.1 g/cm3
    Boiling Point: 299.4±8.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 53.9±3.0 kJ/mol
    Flash Point: 127.3±10.7 °C
    Index of Refraction: 1.481
    Molar Refractivity: 62.8±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 4.34
    ACD/LogD (pH 5.5): 4.00
    ACD/BCF (pH 5.5): 646.49
    ACD/KOC (pH 5.5): 3576.03
    ACD/LogD (pH 7.4): 4.00
    ACD/BCF (pH 7.4): 646.49
    ACD/KOC (pH 7.4): 3576.03
    Polar Surface Area: 17 Å2
    Polarizability: 24.9±0.5 10-24cm3
    Surface Tension: 33.5±3.0 dyne/cm
    Molar Volume: 220.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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