ChemSpider 2D Image | (~2~H_3_)-1H-Imidazol-1-ylacetic acid | C5H3D3N2O2

(2H3)-1H-Imidazol-1-ylacetic acid

  • Molecular FormulaC5H3D3N2O2
  • Average mass129.132 Da
  • Monoisotopic mass129.061752 Da
  • ChemSpider ID58779909

  • Non-standard isotope - Non-standard isotope

More details:

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

(2H3)-1H-Imidazol-1-ylacetic acid [ACD/IUPAC Name]
(2H3)-1H-Imidazol-1-ylessigsäure [German] [ACD/IUPAC Name]
1H-Imidazole-2,4,5-d3-1-acetic acid [ACD/Index Name]
Acide (2H3)-1H-imidazol-1-ylacétique [French] [ACD/IUPAC 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: 392.1±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.7±3.0 kJ/mol
Flash Point: 190.9±23.2 °C
Index of Refraction: 1.588
Molar Refractivity: 31.7±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.57
ACD/LogD (pH 5.5): -2.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.31
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 55 Å2
Polarizability: 12.6±0.5 10-24cm3
Surface Tension: 55.8±7.0 dyne/cm
Molar Volume: 94.3±7.0 cm3

Click to predict properties on the Chemicalize site


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