ChemSpider 2D Image | 4-(4-butylcyclohexyl) cyclohexanone | C16H28O

4-(4-butylcyclohexyl) cyclohexanone

  • Molecular FormulaC16H28O
  • Average mass236.393 Da
  • Monoisotopic mass236.214020 Da
  • ChemSpider ID24751283

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1's,4'r)-4'-Butyl-1,1'-bi(cyclohexyl)-4-on [German] [ACD/IUPAC Name]
(1's,4'r)-4'-Butyl-1,1'-bi(cyclohexyl)-4-one [ACD/IUPAC Name]
(1's,4'r)-4'-Butyl-1,1'-bi(cyclohexyl)-4-one [French] [ACD/IUPAC Name]
[1,1'-Bicyclohexyl]-4-one, 4'-butyl- [ACD/Index Name]
4-(4-butylcyclohexyl) cyclohexanone
92413-47-3 [RN]
trans-[4'-Butyl-1,1'-bicyclohexyl]-4-one
(1's,4'r)-4'-butyl-[1,1'-bi(cyclohexan)]-4-one
[92413-47-3] [RN]
4-(4-butylcyclohexyl)cyclohexan-1-one
More...

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: 327.8±10.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.0±3.0 kJ/mol
    Flash Point: 144.3±11.3 °C
    Index of Refraction: 1.480
    Molar Refractivity: 72.1±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 1
    ACD/LogP: 5.40
    ACD/LogD (pH 5.5): 4.86
    ACD/BCF (pH 5.5): 2913.37
    ACD/KOC (pH 5.5): 10505.34
    ACD/LogD (pH 7.4): 4.86
    ACD/BCF (pH 7.4): 2913.37
    ACD/KOC (pH 7.4): 10505.34
    Polar Surface Area: 17 Å2
    Polarizability: 28.6±0.5 10-24cm3
    Surface Tension: 33.7±3.0 dyne/cm
    Molar Volume: 253.6±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement