ChemSpider 2D Image | 4-(2-Chlorophenyl)-3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-N-(3-methoxypropyl)-1-butanamine | C21H34ClNO2

4-(2-Chlorophenyl)-3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-N-(3-methoxypropyl)-1-butanamine

  • Molecular FormulaC21H34ClNO2
  • Average mass367.953 Da
  • Monoisotopic mass367.227814 Da
  • ChemSpider ID21529340

More details:

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

2H-Pyran-4-propanamine, γ-[(2-chlorophenyl)methyl]tetrahydro-N-(3-methoxypropyl)-2,2-dimethyl- [ACD/Index Name]
4-(2-Chlorophenyl)-3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-N-(3-methoxypropyl)-1-butanamine [ACD/IUPAC Name]
4-(2-Chlorophényl)-3-(2,2-diméthyltétrahydro-2H-pyran-4-yl)-N-(3-méthoxypropyl)-1-butanamine [French] [ACD/IUPAC Name]
4-(2-Chlorphenyl)-3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-N-(3-methoxypropyl)-1-butanamin [German] [ACD/IUPAC Name]
4-(2-chlorophenyl)-3-(2,2-dimethyloxan-4-yl)-N-(3-methoxypropyl)butan-1-amine
4-(2-chlorophenyl)-3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-N-(3-methoxypropyl)butan-1-amine
902246-48-4 [RN]

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 463.3±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 72.5±3.0 kJ/mol
    Flash Point: 234.0±25.9 °C
    Index of Refraction: 1.502
    Molar Refractivity: 105.7±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 0
    ACD/LogP: 3.74
    ACD/LogD (pH 5.5): 1.53
    ACD/BCF (pH 5.5): 1.55
    ACD/KOC (pH 5.5): 6.29
    ACD/LogD (pH 7.4): 1.97
    ACD/BCF (pH 7.4): 4.27
    ACD/KOC (pH 7.4): 17.37
    Polar Surface Area: 30 Å2
    Polarizability: 41.9±0.5 10-24cm3
    Surface Tension: 35.3±3.0 dyne/cm
    Molar Volume: 358.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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