ChemSpider 2D Image | N,1-Bis[(~2~H_3_)methyl]-4-[(~2~H_3_)methylamino]-1H-imidazole-5-carboxamide | C7H3D9N4O

N,1-Bis[(2H3)methyl]-4-[(2H3)methylamino]-1H-imidazole-5-carboxamide

  • Molecular FormulaC7H3D9N4O
  • Average mass177.252 Da
  • Monoisotopic mass177.157608 Da
  • ChemSpider ID58779150
  • Non-standard isotope - Non-standard isotope


More details:






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

1H-Imidazole-5-carboxamide, N,1-di(methyl-d3)-4-(methyl-d3-amino)- [ACD/Index Name]
N,1-Bis[(2H3)methyl]-4-[(2H3)methylamino]-1H-imidazol-5-carboxamid [German] [ACD/IUPAC Name]
N,1-Bis[(2H3)methyl]-4-[(2H3)methylamino]-1H-imidazole-5-carboxamide [ACD/IUPAC Name]
N,1-Bis[(2H3)méthyl]-4-[(2H3)méthylamino]-1H-imidazole-5-carboxamide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 452.0±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.1±3.0 kJ/mol
Flash Point: 227.2±24.6 °C
Index of Refraction: 1.585
Molar Refractivity: 45.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.97
ACD/LogD (pH 5.5): 0.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 10.54
ACD/LogD (pH 7.4): 0.77
ACD/BCF (pH 7.4): 2.23
ACD/KOC (pH 7.4): 60.68
Polar Surface Area: 59 Å2
Polarizability: 18.1±0.5 10-24cm3
Surface Tension: 41.7±7.0 dyne/cm
Molar Volume: 136.3±7.0 cm3

Click to predict properties on the Chemicalize site






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