ChemSpider 2D Image | 2-[(E)-2-(4-Chlorophenyl)vinyl]-1-[4-(4-isopropylphenoxy)butyl]-1H-benzimidazole | C28H29ClN2O

2-[(E)-2-(4-Chlorophenyl)vinyl]-1-[4-(4-isopropylphenoxy)butyl]-1H-benzimidazole

  • Molecular FormulaC28H29ClN2O
  • Average mass444.996 Da
  • Monoisotopic mass444.196838 Da
  • ChemSpider ID23438742

  • Double-bond stereo - Double-bond stereo

More details:

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

1H-Benzimidazole, 2-[(E)-2-(4-chlorophenyl)ethenyl]-1-[4-[4-(1-methylethyl)phenoxy]butyl]- [ACD/Index Name]
2-[(E)-2-(4-Chlorophenyl)vinyl]-1-[4-(4-isopropylphenoxy)butyl]-1H-benzimidazole [ACD/IUPAC Name]
2-[(E)-2-(4-Chlorophényl)vinyl]-1-[4-(4-isopropylphénoxy)butyl]-1H-benzimidazole [French] [ACD/IUPAC Name]
2-[(E)-2-(4-Chlorphenyl)vinyl]-1-[4-(4-isopropylphenoxy)butyl]-1H-benzimidazol [German] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 629.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.1±3.0 kJ/mol
Flash Point: 334.6±34.3 °C
Index of Refraction: 1.588
Molar Refractivity: 134.0±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 8.93
ACD/LogD (pH 5.5): 7.19
ACD/BCF (pH 5.5): 159932.27
ACD/KOC (pH 5.5): 169596.48
ACD/LogD (pH 7.4): 7.32
ACD/BCF (pH 7.4): 215123.73
ACD/KOC (pH 7.4): 228123.00
Polar Surface Area: 27 Å2
Polarizability: 53.1±0.5 10-24cm3
Surface Tension: 40.2±7.0 dyne/cm
Molar Volume: 398.5±7.0 cm3

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