ChemSpider 2D Image | 6-[(4-Bromo-2-chlorophenyl)amino]-7-fluoro-1-methyl-1H-benzimidazole-5-carboxylic acid | C15H10BrClFN3O2

6-[(4-Bromo-2-chlorophenyl)amino]-7-fluoro-1-methyl-1H-benzimidazole-5-carboxylic acid

  • Molecular FormulaC15H10BrClFN3O2
  • Average mass398.614 Da
  • Monoisotopic mass396.962891 Da
  • ChemSpider ID19949404

More details:

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

1H-Benzimidazole-5-carboxylic acid, 6-[(4-bromo-2-chlorophenyl)amino]-7-fluoro-1-methyl- [ACD/Index Name]
6-[(4-Brom-2-chlorphenyl)amino]-7-fluor-1-methyl-1H-benzimidazol-5-carbonsäure [German] [ACD/IUPAC Name]
6-[(4-Bromo-2-chlorophenyl)amino]-7-fluoro-1-methyl-1H-benzimidazole-5-carboxylic acid [ACD/IUPAC Name]
Acide 6-[(4-bromo-2-chlorophényl)amino]-7-fluoro-1-méthyl-1H-benzimidazole-5-carboxylique [French] [ACD/IUPAC Name]
1266693-76-8 [RN]
6-[(4-Bromo-2-chlorophenyl)amino]-7-fluoro-1-methyl-1,3-benzodiazole-5-carboxylic acid
6-[(4-bromo-2-chlorophenyl)amino]-7-fluoro-1-methyl-1H-1,3-benzodiazole-5-carboxylic acid
MFCD21090546
NS-05812

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

Density: 1.8±0.1 g/cm3
Boiling Point: 507.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.9±3.0 kJ/mol
Flash Point: 260.8±32.9 °C
Index of Refraction: 1.698
Molar Refractivity: 87.6±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.85
ACD/LogD (pH 5.5): 3.66
ACD/BCF (pH 5.5): 135.81
ACD/KOC (pH 5.5): 373.79
ACD/LogD (pH 7.4): 2.38
ACD/BCF (pH 7.4): 7.18
ACD/KOC (pH 7.4): 19.77
Polar Surface Area: 67 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 55.1±7.0 dyne/cm
Molar Volume: 227.2±7.0 cm3

Click to predict properties on the Chemicalize site


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