ChemSpider 2D Image | N-(3-Cyclopropyl-3-methyl-4-phenylbutyl)-2,2-dimethyltetrahydro-2H-pyran-4-amine | C21H33NO

N-(3-Cyclopropyl-3-methyl-4-phenylbutyl)-2,2-dimethyltetrahydro-2H-pyran-4-amine

  • Molecular FormulaC21H33NO
  • Average mass315.493 Da
  • Monoisotopic mass315.256226 Da
  • ChemSpider ID23495241

More details:

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

2H-Pyran-4-amine, N-(3-cyclopropyl-3-methyl-4-phenylbutyl)tetrahydro-2,2-dimethyl- [ACD/Index Name]
N-(3-Cyclopropyl-3-methyl-4-phenylbutyl)-2,2-dimethyltetrahydro-2H-pyran-4-amin [German] [ACD/IUPAC Name]
N-(3-Cyclopropyl-3-methyl-4-phenylbutyl)-2,2-dimethyltetrahydro-2H-pyran-4-amine [ACD/IUPAC Name]
N-(3-Cyclopropyl-3-méthyl-4-phénylbutyl)-2,2-diméthyltétrahydro-2H-pyran-4-amine [French] [ACD/IUPAC Name]
1144473-72-2 [RN]
N-(3-cyclopropyl-3-methyl-4-phenylbutyl)-2,2-dimethyloxan-4-amine

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 432.0±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 68.8±3.0 kJ/mol
    Flash Point: 190.4±18.2 °C
    Index of Refraction: 1.534
    Molar Refractivity: 97.5±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 4.66
    ACD/LogD (pH 5.5): 1.73
    ACD/BCF (pH 5.5): 2.22
    ACD/KOC (pH 5.5): 8.20
    ACD/LogD (pH 7.4): 2.34
    ACD/BCF (pH 7.4): 8.90
    ACD/KOC (pH 7.4): 32.81
    Polar Surface Area: 21 Å2
    Polarizability: 38.6±0.5 10-24cm3
    Surface Tension: 38.7±5.0 dyne/cm
    Molar Volume: 313.8±5.0 cm3

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