ChemSpider 2D Image | 5-Nitro-2-(4-propoxybenzyl)-1-[2-(1-pyrrolidinyl)ethyl]-1H-benzimidazole | C23H28N4O3

5-Nitro-2-(4-propoxybenzyl)-1-[2-(1-pyrrolidinyl)ethyl]-1H-benzimidazole

  • Molecular FormulaC23H28N4O3
  • Average mass408.493 Da
  • Monoisotopic mass408.216156 Da
  • ChemSpider ID115005635

More details:

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

1H-Benzimidazole, 5-nitro-2-[(4-propoxyphenyl)methyl]-1-[2-(1-pyrrolidinyl)ethyl]- [ACD/Index Name]
5-Nitro-2-(4-propoxybenzyl)-1-[2-(1-pyrrolidinyl)ethyl]-1H-benzimidazol [German] [ACD/IUPAC Name]
5-Nitro-2-(4-propoxybenzyl)-1-[2-(1-pyrrolidinyl)ethyl]-1H-benzimidazole [ACD/IUPAC Name]
5-Nitro-2-(4-propoxybenzyl)-1-[2-(1-pyrrolidinyl)éthyl]-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: 616.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.4±3.0 kJ/mol
Flash Point: 326.4±30.1 °C
Index of Refraction: 1.632
Molar Refractivity: 116.2±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 5.32
ACD/LogD (pH 5.5): 1.54
ACD/BCF (pH 5.5): 1.58
ACD/KOC (pH 5.5): 6.43
ACD/LogD (pH 7.4): 2.18
ACD/BCF (pH 7.4): 6.91
ACD/KOC (pH 7.4): 28.08
Polar Surface Area: 76 Å2
Polarizability: 46.1±0.5 10-24cm3
Surface Tension: 50.4±7.0 dyne/cm
Molar Volume: 325.8±7.0 cm3

Click to predict properties on the Chemicalize site


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