ChemSpider 2D Image | 2-[1-(4-Isobutylphenyl)ethyl]-1-[2-(2-isopropyl-5-methylphenoxy)ethyl]-1H-benzimidazole | C31H38N2O

2-[1-(4-Isobutylphenyl)ethyl]-1-[2-(2-isopropyl-5-methylphenoxy)ethyl]-1H-benzimidazole

  • Molecular FormulaC31H38N2O
  • Average mass454.646 Da
  • Monoisotopic mass454.298401 Da
  • ChemSpider ID23435231

More details:

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

1H-Benzimidazole, 1-[2-[5-methyl-2-(1-methylethyl)phenoxy]ethyl]-2-[1-[4-(2-methylpropyl)phenyl]ethyl]- [ACD/Index Name]
2-[1-(4-Isobutylphenyl)ethyl]-1-[2-(2-isopropyl-5-methylphenoxy)ethyl]-1H-benzimidazol [German] [ACD/IUPAC Name]
2-[1-(4-Isobutylphenyl)ethyl]-1-[2-(2-isopropyl-5-methylphenoxy)ethyl]-1H-benzimidazole [ACD/IUPAC Name]
2-[1-(4-Isobutylphényl)éthyl]-1-[2-(2-isopropyl-5-méthylphénoxy)éthyl]-1H-benzimidazole [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 617.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.2±3.0 kJ/mol
Flash Point: 327.0±31.5 °C
Index of Refraction: 1.571
Molar Refractivity: 142.5±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 9.70
ACD/LogD (pH 5.5): 8.17
ACD/BCF (pH 5.5): 882834.81
ACD/KOC (pH 5.5): 568382.38
ACD/LogD (pH 7.4): 8.32
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 800983.50
Polar Surface Area: 27 Å2
Polarizability: 56.5±0.5 10-24cm3
Surface Tension: 35.6±7.0 dyne/cm
Molar Volume: 433.9±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement