ChemSpider 2D Image | 1-(5-Chloro-6-fluoro-1H-benzimidazol-2-yl)-1H-pyrazole-4-carboxylic acid | C11H6ClFN4O2

1-(5-Chloro-6-fluoro-1H-benzimidazol-2-yl)-1H-pyrazole-4-carboxylic acid

  • Molecular FormulaC11H6ClFN4O2
  • Average mass280.642 Da
  • Monoisotopic mass280.016327 Da
  • ChemSpider ID25056401

More details:

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

1-(5-Chlor-6-fluor-1H-benzimidazol-2-yl)-1H-pyrazol-4-carbonsäure [German] [ACD/IUPAC Name]
1-(5-Chloro-6-fluoro-1H-benzimidazol-2-yl)-1H-pyrazole-4-carboxylic acid [ACD/IUPAC Name]
1H-Pyrazole-4-carboxylic acid, 1-(5-chloro-6-fluoro-1H-benzimidazol-2-yl)- [ACD/Index Name]
Acide 1-(5-chloro-6-fluoro-1H-benzimidazol-2-yl)-1H-pyrazole-4-carboxylique [French] [ACD/IUPAC Name]

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

014 [DBID]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 602.8±63.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.3±3.0 kJ/mol
Flash Point: 318.3±33.7 °C
Index of Refraction: 1.772
Molar Refractivity: 64.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.98
ACD/LogD (pH 5.5): 0.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.68
ACD/LogD (pH 7.4): -0.88
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 84 Å2
Polarizability: 25.7±0.5 10-24cm3
Surface Tension: 68.4±7.0 dyne/cm
Molar Volume: 155.9±7.0 cm3

Click to predict properties on the Chemicalize site


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