ChemSpider 2D Image | N-(1,3-Benzodioxol-5-ylmethyl)-1H-indole-4-methanamine | C17H16N2O2

N-(1,3-Benzodioxol-5-ylmethyl)-1H-indole-4-methanamine

  • Molecular FormulaC17H16N2O2
  • Average mass280.321 Da
  • Monoisotopic mass280.121185 Da
  • ChemSpider ID21330059

More details:

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

(2H-1,3-benzodioxol-5-ylmethyl)(1H-indol-4-ylmethyl)amine
[(2H-1,3-benzodioxol-5-yl)methyl][(1H-indol-4-yl)methyl]amine
1-(1,3-Benzodioxol-5-yl)-N-(1H-indol-4-ylmethyl)methanamin [German] [ACD/IUPAC Name]
1-(1,3-Benzodioxol-5-yl)-N-(1H-indol-4-ylmethyl)methanamine [ACD/IUPAC Name]
1-(1,3-Benzodioxol-5-yl)-N-(1H-indol-4-ylméthyl)méthanamine [French] [ACD/IUPAC Name]
1H-Indole-4-methanamine, N-(1,3-benzodioxol-5-ylmethyl)- [ACD/Index Name]
944897-10-3 [RN]
N-((1H-indol-4-yl)methyl)-1-(benzo[d][1,3]dioxol-5-yl)methanamine
N-(1,3-Benzodioxol-5-ylmethyl)-1H-indole-4-methanamine
(1,3-benzodioxol-5-ylmethyl)(1H-indol-4-ylmethyl)amine
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 476.5±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 74.0±3.0 kJ/mol
    Flash Point: 242.0±27.3 °C
    Index of Refraction: 1.690
    Molar Refractivity: 82.3±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 3.21
    ACD/LogD (pH 5.5): -0.05
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 1.29
    ACD/BCF (pH 7.4): 2.29
    ACD/KOC (pH 7.4): 21.77
    Polar Surface Area: 46 Å2
    Polarizability: 32.6±0.5 10-24cm3
    Surface Tension: 61.3±3.0 dyne/cm
    Molar Volume: 215.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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