ChemSpider 2D Image | 1-[3-(Hexyloxy)-5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-2-naphthalenyl]-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid | C29H35F3N2O3

1-[3-(Hexyloxy)-5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-2-naphthalenyl]-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid

  • Molecular FormulaC29H35F3N2O3
  • Average mass516.595 Da
  • Monoisotopic mass516.259949 Da
  • ChemSpider ID115007737

More details:

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

1-[3-(Hexyloxy)-5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-2-naphthalenyl]-2-(trifluoromethyl)-1H-benzimidazole-5-carboxylic acid [ACD/IUPAC Name]
1-[3-(Hexyloxy)-5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-2-naphthalinyl]-2-(trifluormethyl)-1H-benzimidazol-5-carbonsäure [German] [ACD/IUPAC Name]
1H-Benzimidazole-5-carboxylic acid, 1-[3-(hexyloxy)-5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl]-2-(trifluoromethyl)- [ACD/Index Name]
Acide 1-[3-(hexyloxy)-5,5,8,8-tétraméthyl-5,6,7,8-tétrahydro-2-naphtalényl]-2-(trifluorométhyl)-1H-benzimidazole-5-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 605.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.6±3.0 kJ/mol
Flash Point: 319.8±34.3 °C
Index of Refraction: 1.560
Molar Refractivity: 136.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 10.90
ACD/LogD (pH 5.5): 7.19
ACD/BCF (pH 5.5): 60758.43
ACD/KOC (pH 5.5): 27125.59
ACD/LogD (pH 7.4): 6.00
ACD/BCF (pH 7.4): 3944.36
ACD/KOC (pH 7.4): 1760.96
Polar Surface Area: 64 Å2
Polarizability: 54.1±0.5 10-24cm3
Surface Tension: 38.0±7.0 dyne/cm
Molar Volume: 421.8±7.0 cm3

Click to predict properties on the Chemicalize site


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