ChemSpider 2D Image | N~4~-[4-Amino(4,4-~2~H_2_)butyl]-1,4-(1,1-~2~H_2_)butanediamine | C8H17D4N3

N4-[4-Amino(4,4-2H2)butyl]-1,4-(1,1-2H2)butanediamine

  • Molecular FormulaC8H17D4N3
  • Average mass163.297 Da
  • Monoisotopic mass163.198654 Da
  • ChemSpider ID48062753

  • Non-standard isotope - Non-standard isotope

More details:

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

1,4-Butane-1,1-d2-diamine, N4-(4-aminobutyl-4,4-d2)- [ACD/Index Name]
N4-[4-Amino(4,4-2H2)butyl]-1,4-(1,1-2H2)butandiamin [German] [ACD/IUPAC Name]
N4-[4-Amino(4,4-2H2)butyl]-1,4-(1,1-2H2)butanediamine [ACD/IUPAC Name]
N4-[4-Amino(4,4-2H2)butyl]-1,4-(1,1-2H2)butanediamine [French] [ACD/IUPAC Name]
856869-03-9 [RN]
N'-(4-amino-4,4-dideuteriobutyl)-1,1-dideuteriobutane-1,4-diamine
N4-[4-Amino(4,4-2H2)butyl](1,1-2H2)butane-1,4-diamine

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

    Density: 0.9±0.1 g/cm3
    Boiling Point: 259.1±8.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 49.7±3.0 kJ/mol
    Flash Point: 127.3±22.0 °C
    Index of Refraction: 1.475
    Molar Refractivity: 49.8±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 5
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 1
    ACD/LogP: -0.54
    ACD/LogD (pH 5.5): -5.85
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -5.79
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 64 Å2
    Polarizability: 19.7±0.5 10-24cm3
    Surface Tension: 37.2±3.0 dyne/cm
    Molar Volume: 176.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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