ChemSpider 2D Image | tert-Butyl 4-((2-methoxyethyl)amino)azepane-1-carboxylate | C14H28N2O3

tert-Butyl 4-((2-methoxyethyl)amino)azepane-1-carboxylate

  • Molecular FormulaC14H28N2O3
  • Average mass272.384 Da
  • Monoisotopic mass272.209991 Da
  • ChemSpider ID24609646

More details:

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

1223748-50-2 [RN]
tert-Butyl 4-((2-methoxyethyl)amino)azepane-1-carboxylate
[1223748-50-2] [RN]
MFCD15072121 [MDL number]
tert-butyl 4-(2- methoxyethylamino)azepane-1-carboxylate
tert-Butyl 4-(2-methoxyethylamino)azepane-1-carboxylate
tert-Butyl 4-[(2-methoxyethyl)amino]azepane-1-carboxylate
tert-butyl4-(2-methoxyethylamino)azepane-1-carboxylate

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 354.9±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.0±3.0 kJ/mol
    Flash Point: 168.4±25.1 °C
    Index of Refraction: 1.484
    Molar Refractivity: 75.9±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 1.42
    ACD/LogD (pH 5.5): -0.92
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.44
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 7.71
    Polar Surface Area: 51 Å2
    Polarizability: 30.1±0.5 10-24cm3
    Surface Tension: 37.2±5.0 dyne/cm
    Molar Volume: 265.5±5.0 cm3

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