ChemSpider 2D Image | 1,2-Phenylenediamine-d4 | C6H4D4N2

1,2-Phenylenediamine-d4

  • Molecular FormulaC6H4D4N2
  • Average mass112.166 Da
  • Monoisotopic mass112.093857 Da
  • ChemSpider ID8948265
  • Non-standard isotope - Non-standard isotope


More details:






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

(2H4)Benzene-1,2-diamine
1,2-(2H4)Benzenediamine [ACD/IUPAC Name]
1,2-(2H4)Benzènediamine [French] [ACD/IUPAC Name]
1,2-(2H4)Benzoldiamin [German] [ACD/IUPAC Name]
1,2-benzene-d4-diamine [ACD/Index Name]
1,2-Phenylenediamine-d4
291765-93-0 [RN]
1,2-Benzene-d4-diamine
1,2-diaminobenzene
1,2-Phenylenediamine
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 257.0±0.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 49.5±3.0 kJ/mol
    Flash Point: 124.9±19.3 °C
    Index of Refraction: 1.661
    Molar Refractivity: 34.7±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 4
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 0.05
    ACD/LogD (pH 5.5): 0.32
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 34.04
    ACD/LogD (pH 7.4): 0.35
    ACD/BCF (pH 7.4): 1.09
    ACD/KOC (pH 7.4): 37.10
    Polar Surface Area: 52 Å2
    Polarizability: 13.8±0.5 10-24cm3
    Surface Tension: 57.6±3.0 dyne/cm
    Molar Volume: 94.0±3.0 cm3

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