ChemSpider 2D Image | 2-(4-Ethoxybenzyl)-1-[2-(1-methyl-2-pyrrolidinyl)ethyl]-5-nitro-1H-benzimidazole | C23H28N4O3

2-(4-Ethoxybenzyl)-1-[2-(1-methyl-2-pyrrolidinyl)ethyl]-5-nitro-1H-benzimidazole

  • Molecular FormulaC23H28N4O3
  • Average mass408.493 Da
  • Monoisotopic mass408.216156 Da
  • ChemSpider ID28524088

More details:

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

1H-Benzimidazole, 2-[(4-ethoxyphenyl)methyl]-1-[2-(1-methyl-2-pyrrolidinyl)ethyl]-5-nitro- [ACD/Index Name]
2-(4-Ethoxybenzyl)-1-[2-(1-methyl-2-pyrrolidinyl)ethyl]-5-nitro-1H-benzimidazol [German] [ACD/IUPAC Name]
2-(4-Ethoxybenzyl)-1-[2-(1-methyl-2-pyrrolidinyl)ethyl]-5-nitro-1H-benzimidazole [ACD/IUPAC Name]
2-(4-Éthoxybenzyl)-1-[2-(1-méthyl-2-pyrrolidinyl)éthyl]-5-nitro-1H-benzimidazole [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: 602.8±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.7±3.0 kJ/mol
Flash Point: 318.4±27.3 °C
Index of Refraction: 1.633
Molar Refractivity: 116.0±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.74
ACD/LogD (pH 5.5): 1.41
ACD/BCF (pH 5.5): 1.26
ACD/KOC (pH 5.5): 5.41
ACD/LogD (pH 7.4): 1.79
ACD/BCF (pH 7.4): 3.03
ACD/KOC (pH 7.4): 13.05
Polar Surface Area: 76 Å2
Polarizability: 46.0±0.5 10-24cm3
Surface Tension: 49.2±7.0 dyne/cm
Molar Volume: 325.0±7.0 cm3

Click to predict properties on the Chemicalize site


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