ChemSpider 2D Image | (2,5-~2~H_2_)-1H-Imidazol-4-ylmethanol | C4H4D2N2O

(2,5-2H2)-1H-Imidazol-4-ylmethanol

  • Molecular FormulaC4H4D2N2O
  • Average mass100.116 Da
  • Monoisotopic mass100.060570 Da
  • ChemSpider ID9518932

  • Non-standard isotope - Non-standard isotope

More details:

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

(2,5-2H2)-1H-Imidazol-4-ylmethanol [ACD/IUPAC Name]
(2,5-2H2)-1H-Imidazol-4-ylmethanol [German] [ACD/IUPAC Name]
(2,5-2H2)-1H-Imidazol-4-ylméthanol [French] [ACD/IUPAC Name]
1H-Imidazole-2,5-d2-4-methanol [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 393.7±17.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.9±3.0 kJ/mol
Flash Point: 191.9±20.9 °C
Index of Refraction: 1.590
Molar Refractivity: 25.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.34
ACD/LogD (pH 5.5): -1.96
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.81
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.94
Polar Surface Area: 49 Å2
Polarizability: 10.0±0.5 10-24cm3
Surface Tension: 67.7±3.0 dyne/cm
Molar Volume: 74.8±3.0 cm3

Click to predict properties on the Chemicalize site


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