ChemSpider 2D Image | N-[1-(7-Methoxy-1-benzofuran-2-yl)ethyl]cycloheptanamine | C18H25NO2

N-[1-(7-Methoxy-1-benzofuran-2-yl)ethyl]cycloheptanamine

  • Molecular FormulaC18H25NO2
  • Average mass287.397 Da
  • Monoisotopic mass287.188538 Da
  • ChemSpider ID21800542

More details:

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

1036559-22-4 [RN]
2-Benzofuranmethanamine, N-cycloheptyl-7-methoxy-α-methyl- [ACD/Index Name]
N-[1-(7-Methoxy-1-benzofuran-2-yl)ethyl]cycloheptanamin [German] [ACD/IUPAC Name]
N-[1-(7-Methoxy-1-benzofuran-2-yl)ethyl]cycloheptanamine [ACD/IUPAC Name]
N-[1-(7-Méthoxy-1-benzofuran-2-yl)éthyl]cycloheptanamine [French] [ACD/IUPAC Name]
cycloheptyl[(7-methoxybenzo[d]furan-2-yl)ethyl]amine
N-(1-(7-methoxybenzofuran-2-yl)ethyl)cycloheptanamine
N-[1-(7-Methoxy-1-benzofuran-2-yl)ethyl]-cycloheptanamine

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

MFCD12027181 [DBID]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 403.4±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 65.5±3.0 kJ/mol
    Flash Point: 197.8±24.6 °C
    Index of Refraction: 1.564
    Molar Refractivity: 86.4±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 4.76
    ACD/LogD (pH 5.5): 1.57
    ACD/BCF (pH 5.5): 1.78
    ACD/KOC (pH 5.5): 7.54
    ACD/LogD (pH 7.4): 2.90
    ACD/BCF (pH 7.4): 38.18
    ACD/KOC (pH 7.4): 162.18
    Polar Surface Area: 34 Å2
    Polarizability: 34.3±0.5 10-24cm3
    Surface Tension: 42.3±5.0 dyne/cm
    Molar Volume: 265.8±5.0 cm3

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