ChemSpider 2D Image | 3-(~2~H_3_)Methyl-1,2-benzenediamine | C7H7D3N2

3-(2H3)Methyl-1,2-benzenediamine

  • Molecular FormulaC7H7D3N2
  • Average mass125.186 Da
  • Monoisotopic mass125.103226 Da
  • ChemSpider ID48058215

  • Non-standard isotope - Non-standard isotope

More details:

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

1,2-Benzenediamine, 3-(methyl-d3)- [ACD/Index Name]
3-(2H3)Methyl-1,2-benzenediamine [ACD/IUPAC Name]
3-(2H3)Méthyl-1,2-benzènediamine [French] [ACD/IUPAC Name]
3-(2H3)Methyl-1,2-benzoldiamin [German] [ACD/IUPAC Name]
1246820-38-1 [RN]
2,3-diaminotoluene-d3
3-(trideuteriomethyl)benzene-1,2-diamine

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 255.0±0.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 49.2±3.0 kJ/mol
    Flash Point: 131.1±21.3 °C
    Index of Refraction: 1.636
    Molar Refractivity: 39.5±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 4
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 0.51
    ACD/LogD (pH 5.5): 0.60
    ACD/BCF (pH 5.5): 1.64
    ACD/KOC (pH 5.5): 48.47
    ACD/LogD (pH 7.4): 0.64
    ACD/BCF (pH 7.4): 1.80
    ACD/KOC (pH 7.4): 52.93
    Polar Surface Area: 52 Å2
    Polarizability: 15.7±0.5 10-24cm3
    Surface Tension: 52.3±3.0 dyne/cm
    Molar Volume: 110.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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