ChemSpider 2D Image | Bis[(~2~H_3_)-1H-imidazol-1-yl]methanone | C7D6N4O

Bis[(2H3)-1H-imidazol-1-yl]methanone

  • Molecular FormulaC7D6N4O
  • Average mass168.186 Da
  • Monoisotopic mass168.091827 Da
  • ChemSpider ID111332439

  • Non-standard isotope - Non-standard isotope

More details:

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

Bis[(2H3)-1H-imidazol-1-yl]methanon [German] [ACD/IUPAC Name]
Bis[(2H3)-1H-imidazol-1-yl]methanone [ACD/IUPAC Name]
Bis[(2H3)-1H-imidazol-1-yl]méthanone [French] [ACD/IUPAC Name]
Methanone, di-1H-imidazol-1-yl-d3- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 394.6±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.5±3.0 kJ/mol
Flash Point: 192.5±23.2 °C
Index of Refraction: 1.691
Molar Refractivity: 44.6±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.64
ACD/LogD (pH 5.5): -0.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 12.69
ACD/LogD (pH 7.4): -0.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 12.72
Polar Surface Area: 53 Å2
Polarizability: 17.7±0.5 10-24cm3
Surface Tension: 63.3±7.0 dyne/cm
Molar Volume: 116.5±7.0 cm3

Click to predict properties on the Chemicalize site


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