ChemSpider 2D Image | Ethyl 1-[2-(4-morpholinyl)ethyl]-2-[4-(trifluoromethyl)phenyl]-1H-benzimidazole-5-carboxylate | C23H24F3N3O3

Ethyl 1-[2-(4-morpholinyl)ethyl]-2-[4-(trifluoromethyl)phenyl]-1H-benzimidazole-5-carboxylate

  • Molecular FormulaC23H24F3N3O3
  • Average mass447.450 Da
  • Monoisotopic mass447.176971 Da
  • ChemSpider ID30656639

More details:

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

1-[2-(4-Morpholinyl)éthyl]-2-[4-(trifluorométhyl)phényl]-1H-benzimidazole-5-carboxylate d'éthyle [French] [ACD/IUPAC Name]
1H-Benzimidazole-5-carboxylic acid, 1-[2-(4-morpholinyl)ethyl]-2-[4-(trifluoromethyl)phenyl]-, ethyl ester [ACD/Index Name]
Ethyl 1-[2-(4-morpholinyl)ethyl]-2-[4-(trifluoromethyl)phenyl]-1H-benzimidazole-5-carboxylate [ACD/IUPAC Name]
Ethyl-1-[2-(4-morpholinyl)ethyl]-2-[4-(trifluormethyl)phenyl]-1H-benzimidazol-5-carboxylat [German] [ACD/IUPAC Name]
Ethyl 2-(4-(trifluoromethyl)phenyl)-1-(2-morpholinoethyl)-1H-benzo[d]imidazole-5-carboxylate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 561.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.5±3.0 kJ/mol
Flash Point: 293.5±32.9 °C
Index of Refraction: 1.582
Molar Refractivity: 112.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.12
ACD/LogD (pH 5.5): 3.30
ACD/BCF (pH 5.5): 93.35
ACD/KOC (pH 5.5): 385.89
ACD/LogD (pH 7.4): 4.49
ACD/BCF (pH 7.4): 1460.41
ACD/KOC (pH 7.4): 6037.30
Polar Surface Area: 57 Å2
Polarizability: 44.8±0.5 10-24cm3
Surface Tension: 42.4±7.0 dyne/cm
Molar Volume: 338.2±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement