ChemSpider 2D Image | 4,5-Bis[(~2~H_3_)methyl]-1,2-(~2~H_2_)benzenediamine | C8H4D8N2

4,5-Bis[(2H3)methyl]-1,2-(2H2)benzenediamine

  • Molecular FormulaC8H4D8N2
  • Average mass144.244 Da
  • Monoisotopic mass144.150269 Da
  • ChemSpider ID58794436

  • Non-standard isotope - Non-standard isotope

More details:

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

1,2-Benzene-3,6-d2-diamine, 4,5-di(methyl-d3)- [ACD/Index Name]
4,5-Bis[(2H3)methyl]-1,2-(2H2)benzenediamine [ACD/IUPAC Name]
4,5-Bis[(2H3)méthyl]-1,2-(2H2)benzènediamine [French] [ACD/IUPAC Name]
4,5-Bis[(2H3)methyl]-1,2-(2H2)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: 279.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.8±3.0 kJ/mol
Flash Point: 144.9±25.4 °C
Index of Refraction: 1.619
Molar Refractivity: 44.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 4
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.97
ACD/LogD (pH 5.5): 1.08
ACD/BCF (pH 5.5): 3.62
ACD/KOC (pH 5.5): 80.58
ACD/LogD (pH 7.4): 1.20
ACD/BCF (pH 7.4): 4.78
ACD/KOC (pH 7.4): 106.57
Polar Surface Area: 52 Å2
Polarizability: 17.6±0.5 10-24cm3
Surface Tension: 48.7±3.0 dyne/cm
Molar Volume: 126.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement