ChemSpider 2D Image | 4-(Aminomethyl)-4-(3-chlorophenyl)cyclohexanol | C13H18ClNO

4-(Aminomethyl)-4-(3-chlorophenyl)cyclohexanol

  • Molecular FormulaC13H18ClNO
  • Average mass239.741 Da
  • Monoisotopic mass239.107697 Da
  • ChemSpider ID21615600

More details:

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

4-(Aminomethyl)-4-(3-chlorophenyl)cyclohexanol [ACD/IUPAC Name]
4-(Aminométhyl)-4-(3-chlorophényl)cyclohexanol [French] [ACD/IUPAC Name]
4-(Aminomethyl)-4-(3-chlorphenyl)cyclohexanol [German] [ACD/IUPAC Name]
Cyclohexanol, 4-(aminomethyl)-4-(3-chlorophenyl)- [ACD/Index Name]
[887978-40-7] [RN]
1037235-77-0 [RN]
4-(aminomethyl)-4-(3-chlorophenyl)cyclohexan-1-ol
887978-40-7 [RN]
MFCD06410569 [MDL number]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 380.3±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 66.3±3.0 kJ/mol
    Flash Point: 183.8±26.5 °C
    Index of Refraction: 1.572
    Molar Refractivity: 66.7±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 3
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.44
    ACD/LogD (pH 5.5): -0.95
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.49
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 46 Å2
    Polarizability: 26.5±0.5 10-24cm3
    Surface Tension: 48.1±3.0 dyne/cm
    Molar Volume: 202.7±3.0 cm3

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