ChemSpider 2D Image | 4,6-Dibutyl-5-hydroxy-2',4'-bis(2-methyl-2-propanyl)-2-biphenylcarboxylic acid | C29H42O3

4,6-Dibutyl-5-hydroxy-2',4'-bis(2-methyl-2-propanyl)-2-biphenylcarboxylic acid

  • Molecular FormulaC29H42O3
  • Average mass438.642 Da
  • Monoisotopic mass438.313385 Da
  • ChemSpider ID114952030

More details:

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

[1,1'-Biphenyl]-2-carboxylic acid, 4,6-dibutyl-2',4'-bis(1,1-dimethylethyl)-5-hydroxy- [ACD/Index Name]
4,6-Dibutyl-5-hydroxy-2',4'-bis(2-methyl-2-propanyl)-2-biphenylcarbonsäure [German] [ACD/IUPAC Name]
4,6-Dibutyl-5-hydroxy-2',4'-bis(2-methyl-2-propanyl)-2-biphenylcarboxylic acid [ACD/IUPAC Name]
Acide 4,6-dibutyl-5-hydroxy-2',4'-bis(2-méthyl-2-propanyl)-2-biphénylcarboxylique [French] [ACD/IUPAC Name]
4,6-dibutyl-2',4'-di-tert-butyl-5-hydroxy-[1,1'-biphenyl]-2-carboxylic acid

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

Density: 1.0±0.1 g/cm3
Boiling Point: 536.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.6±3.0 kJ/mol
Flash Point: 292.5±26.6 °C
Index of Refraction: 1.535
Molar Refractivity: 134.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 10.00
ACD/LogD (pH 5.5): 7.60
ACD/BCF (pH 5.5): 183379.38
ACD/KOC (pH 5.5): 94925.87
ACD/LogD (pH 7.4): 5.97
ACD/BCF (pH 7.4): 4348.57
ACD/KOC (pH 7.4): 2251.02
Polar Surface Area: 58 Å2
Polarizability: 53.1±0.5 10-24cm3
Surface Tension: 37.5±3.0 dyne/cm
Molar Volume: 430.7±3.0 cm3

Click to predict properties on the Chemicalize site


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