ChemSpider 2D Image | 2-(~2~H_3_)Methyl-1,4-(~2~H_3_)benzenediamine | C7H4D6N2

2-(2H3)Methyl-1,4-(2H3)benzenediamine

  • Molecular FormulaC7H4D6N2
  • Average mass128.205 Da
  • Monoisotopic mass128.122055 Da
  • ChemSpider ID58794660

  • Non-standard isotope - Non-standard isotope

More details:

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

1,4-Benzene-2,3,5-d3-diamine, 6-(methyl-d3)- [ACD/Index Name]
2-(2H3)Methyl-1,4-(2H3)benzenediamine [ACD/IUPAC Name]
2-(2H3)Méthyl-1,4-(2H3)benzènediamine [French] [ACD/IUPAC Name]
2-(2H3)Methyl-1,4-(2H3)benzoldiamin [German] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 273.7±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.2±3.0 kJ/mol
Flash Point: 140.6±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: -0.22
ACD/LogD (pH 5.5): -0.58
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.26
ACD/LogD (pH 7.4): 0.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 27.75
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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