ChemSpider 2D Image | 4-Chloro-5-(4-methylphenyl)-1H-imidazole-2-carboxylic acid | C11H9ClN2O2

4-Chloro-5-(4-methylphenyl)-1H-imidazole-2-carboxylic acid

  • Molecular FormulaC11H9ClN2O2
  • Average mass236.654 Da
  • Monoisotopic mass236.035248 Da
  • ChemSpider ID32701163

More details:

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

1287189-46-1 [RN]
1H-Imidazole-2-carboxylic acid, 4-chloro-5-(4-methylphenyl)- [ACD/Index Name]
4-Chlor-5-(4-methylphenyl)-1H-imidazol-2-carbonsäure [German] [ACD/IUPAC Name]
4-Chloro-5-(4-methylphenyl)-1H-imidazole-2-carboxylic acid [ACD/IUPAC Name]
Acide 4-chloro-5-(4-méthylphényl)-1H-imidazole-2-carboxylique [French] [ACD/IUPAC Name]
4-chloro-5-p-tolylimidazole-2-carboxylic acid
CTCA

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

U4M3FW1Y63 [DBID]
UNII:U4M3FW1Y63 [DBID]
UNII-U4M3FW1Y63 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 483.9±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.9±3.0 kJ/mol
Flash Point: 246.4±26.5 °C
Index of Refraction: 1.638
Molar Refractivity: 60.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.11
ACD/LogD (pH 5.5): 0.52
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.65
ACD/LogD (pH 7.4): -0.66
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 66 Å2
Polarizability: 23.8±0.5 10-24cm3
Surface Tension: 62.7±3.0 dyne/cm
Molar Volume: 167.0±3.0 cm3

Click to predict properties on the Chemicalize site


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