ChemSpider 2D Image | (1r,1's,4r,4'S)-4'-Propyl-1,1'-bi(cyclohexyl)-4-ol | C15H28O

(1r,1's,4r,4'S)-4'-Propyl-1,1'-bi(cyclohexyl)-4-ol

  • Molecular FormulaC15H28O
  • Average mass224.382 Da
  • Monoisotopic mass224.214020 Da
  • ChemSpider ID18549684

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(1r,1's,4r,4'S)-4'-Propyl-1,1'-bi(cyclohexyl)-4-ol [ACD/IUPAC Name]
(1r,1's,4r,4'S)-4'-Propyl-1,1'-bi(cyclohexyl)-4-ol [German] [ACD/IUPAC Name]
(1r,1's,4r,4'S)-4'-Propyl-1,1'-bi(cyclohexyl)-4-ol [French] [ACD/IUPAC Name]
(trans,trans)-4'-Propyl-[1,1'-bi(cyclohexan)]-4-ol
[1,1'-Bicyclohexyl]-4-ol, 4'-propyl- [ACD/Index Name]
82832-72-2 [RN]
(trans,trans)-4-propyl-[1,1-bi(cyclohexan)]-4-ol
[82832-72-2] [RN]
DS-5483
MFCD09752068 [MDL number]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 0.9±0.1 g/cm3
    Boiling Point: 317.6±10.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 64.8±6.0 kJ/mol
    Flash Point: 133.5±11.5 °C
    Index of Refraction: 1.492
    Molar Refractivity: 68.9±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 1
    ACD/LogP: 5.45
    ACD/LogD (pH 5.5): 4.91
    ACD/BCF (pH 5.5): 3192.95
    ACD/KOC (pH 5.5): 11217.47
    ACD/LogD (pH 7.4): 4.91
    ACD/BCF (pH 7.4): 3192.95
    ACD/KOC (pH 7.4): 11217.47
    Polar Surface Area: 20 Å2
    Polarizability: 27.3±0.5 10-24cm3
    Surface Tension: 34.8±3.0 dyne/cm
    Molar Volume: 237.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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