ChemSpider 2D Image | 4-(2-Methyl-2-butanyl)azepane | C11H23N

4-(2-Methyl-2-butanyl)azepane

  • Molecular FormulaC11H23N
  • Average mass169.307 Da
  • Monoisotopic mass169.183044 Da
  • ChemSpider ID27982159

More details:

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

1H-Azepine, 4-(1,1-dimethylpropyl)hexahydro- [ACD/Index Name]
4-(2-Methyl-2-butanyl)azepan [German] [ACD/IUPAC Name]
4-(2-Methyl-2-butanyl)azepane [ACD/IUPAC Name]
4-(2-Méthyl-2-butanyl)azépane [French] [ACD/IUPAC Name]
1154906-24-7 [RN]
4-(1,1-Dimethylpropyl)hexahydro-1H-azepine
4-(2-methylbutan-2-yl)azepane
5725-89-3 [RN]
MFCD12174728

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

    Density: 0.8±0.1 g/cm3
    Boiling Point: 213.9±8.0 °C at 760 mmHg
    Vapour Pressure: 0.2±0.4 mmHg at 25°C
    Enthalpy of Vaporization: 45.0±3.0 kJ/mol
    Flash Point: 78.3±16.5 °C
    Index of Refraction: 1.443
    Molar Refractivity: 53.8±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.75
    ACD/LogD (pH 5.5): 0.83
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 2.59
    ACD/LogD (pH 7.4): 0.90
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.05
    Polar Surface Area: 12 Å2
    Polarizability: 21.3±0.5 10-24cm3
    Surface Tension: 27.2±3.0 dyne/cm
    Molar Volume: 203.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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