ChemSpider 2D Image | 1-Chloro-3-(2-methyl-5-nitro-1H-imidazol-1-yl)-2-(~2~H_5_)propanol | C7H5D5ClN3O3

1-Chloro-3-(2-methyl-5-nitro-1H-imidazol-1-yl)-2-(2H5)propanol

  • Molecular FormulaC7H5D5ClN3O3
  • Average mass224.656 Da
  • Monoisotopic mass224.072449 Da
  • ChemSpider ID58785130

  • Non-standard isotope - Non-standard isotope

More details:

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

1-Chlor-3-(2-methyl-5-nitro-1H-imidazol-1-yl)-2-(2H5)propanol [German] [ACD/IUPAC Name]
1-Chloro-3-(2-methyl-5-nitro-1H-imidazol-1-yl)-2-(2H5)propanol [ACD/IUPAC Name]
1-Chloro-3-(2-méthyl-5-nitro-1H-imidazol-1-yl)-2-(2H5)propanol [French] [ACD/IUPAC Name]
1H-Imidazole-1-ethan-α,β,β-d3-ol, α-(chloromethyl-d2)-2-methyl-5-nitro- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 443.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.9±3.0 kJ/mol
Flash Point: 221.9±27.3 °C
Index of Refraction: 1.617
Molar Refractivity: 50.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.69
ACD/LogD (pH 5.5): 0.62
ACD/BCF (pH 5.5): 1.74
ACD/KOC (pH 5.5): 51.68
ACD/LogD (pH 7.4): 0.62
ACD/BCF (pH 7.4): 1.74
ACD/KOC (pH 7.4): 51.77
Polar Surface Area: 84 Å2
Polarizability: 19.9±0.5 10-24cm3
Surface Tension: 58.3±7.0 dyne/cm
Molar Volume: 143.4±7.0 cm3

Click to predict properties on the Chemicalize site


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