ChemSpider 2D Image | 4-(Aminomethyl)-4-(3,4-dichlorophenyl)cyclohexanol | C13H17Cl2NO

4-(Aminomethyl)-4-(3,4-dichlorophenyl)cyclohexanol

  • Molecular FormulaC13H17Cl2NO
  • Average mass274.186 Da
  • Monoisotopic mass273.068726 Da
  • ChemSpider ID21615601

More details:

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

4-(Aminomethyl)-4-(3,4-dichlorophenyl)cyclohexanol [ACD/IUPAC Name]
4-(Aminométhyl)-4-(3,4-dichlorophényl)cyclohexanol [French] [ACD/IUPAC Name]
4-(Aminomethyl)-4-(3,4-dichlorphenyl)cyclohexanol [German] [ACD/IUPAC Name]
Cyclohexanol, 4-(aminomethyl)-4-(3,4-dichlorophenyl)- [ACD/Index Name]
[887978-44-1] [RN]
1363166-13-5 [RN]
4-(Aminomethyl)-4-(3,4-dichlorophenyl)cyclohexan-1-ol
4-Chloro-5-(dimethylamino)-2-phenylpyridazin-3(2H)-one
887978-44-1 [RN]
MFCD06410570 [MDL number]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 404.7±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 69.2±3.0 kJ/mol
    Flash Point: 198.6±28.7 °C
    Index of Refraction: 1.582
    Molar Refractivity: 71.6±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 3
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.91
    ACD/LogD (pH 5.5): -0.15
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.31
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 2.24
    Polar Surface Area: 46 Å2
    Polarizability: 28.4±0.5 10-24cm3
    Surface Tension: 49.6±3.0 dyne/cm
    Molar Volume: 214.7±3.0 cm3

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