ChemSpider 2D Image | 2-[4-(2-Chlorobenzyl)-2-isopropyltetrahydro-2H-pyran-4-yl]-N-[2-(dimethylamino)ethyl]acetamide | C21H33ClN2O2

2-[4-(2-Chlorobenzyl)-2-isopropyltetrahydro-2H-pyran-4-yl]-N-[2-(dimethylamino)ethyl]acetamide

  • Molecular FormulaC21H33ClN2O2
  • Average mass380.952 Da
  • Monoisotopic mass380.223053 Da
  • ChemSpider ID21631013

More details:

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

2-[4-(2-Chlorbenzyl)-2-isopropyltetrahydro-2H-pyran-4-yl]-N-[2-(dimethylamino)ethyl]acetamid [German] [ACD/IUPAC Name]
2-[4-(2-Chlorobenzyl)-2-isopropyltetrahydro-2H-pyran-4-yl]-N-[2-(dimethylamino)ethyl]acetamide [ACD/IUPAC Name]
2-[4-(2-Chlorobenzyl)-2-isopropyltétrahydro-2H-pyran-4-yl]-N-[2-(diméthylamino)éthyl]acétamide [French] [ACD/IUPAC Name]
2H-Pyran-4-acetamide, 4-[(2-chlorophenyl)methyl]-N-[2-(dimethylamino)ethyl]tetrahydro-2-(1-methylethyl)- [ACD/Index Name]
2-[4-[(2-chlorophenyl)methyl]-2-propan-2-yloxan-4-yl]-N-[2-(dimethylamino)ethyl]acetamide
929856-19-9 [RN]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 520.7±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 79.4±3.0 kJ/mol
    Flash Point: 268.7±24.6 °C
    Index of Refraction: 1.519
    Molar Refractivity: 107.7±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 3.42
    ACD/LogD (pH 5.5): 1.61
    ACD/BCF (pH 5.5): 2.71
    ACD/KOC (pH 5.5): 15.45
    ACD/LogD (pH 7.4): 3.31
    ACD/BCF (pH 7.4): 137.21
    ACD/KOC (pH 7.4): 783.61
    Polar Surface Area: 42 Å2
    Polarizability: 42.7±0.5 10-24cm3
    Surface Tension: 38.5±3.0 dyne/cm
    Molar Volume: 355.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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