ChemSpider 2D Image | 4-Propylphenyl 4-(trans-4-butylcyclohexyl)benzoate | C26H34O2

4-Propylphenyl 4-(trans-4-butylcyclohexyl)benzoate

  • Molecular FormulaC26H34O2
  • Average mass378.547 Da
  • Monoisotopic mass378.255890 Da
  • ChemSpider ID28638801

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

4-(trans-4-Butylcyclohexyl)benzoate de 4-propylphényle [French] [ACD/IUPAC Name]
4-Propylphenyl 4-(trans-4-butylcyclohexyl)benzoate [ACD/IUPAC Name]
4-Propylphenyl-4-(trans-4-butylcyclohexyl)benzoat [German] [ACD/IUPAC Name]
Benzoic acid, 4-(trans-4-butylcyclohexyl)-, 4-propylphenyl ester [ACD/Index Name]
4-Propylphenyl-4-Trans-ButylcyclohexylBenzoate
4-PROPYLPHENYL-4'-TRANS-BUTYLCYCLOHEXYLBENZOATE
96155-68-9 [RN]
MFCD09838995 [MDL number]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 503.1±39.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.2±3.0 kJ/mol
Flash Point: 212.9±24.5 °C
Index of Refraction: 1.536
Molar Refractivity: 116.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 9.72
ACD/LogD (pH 5.5): 8.16
ACD/BCF (pH 5.5): 945077.00
ACD/KOC (pH 5.5): 658882.69
ACD/LogD (pH 7.4): 8.16
ACD/BCF (pH 7.4): 945077.00
ACD/KOC (pH 7.4): 658882.69
Polar Surface Area: 26 Å2
Polarizability: 46.2±0.5 10-24cm3
Surface Tension: 38.4±3.0 dyne/cm
Molar Volume: 374.0±3.0 cm3

Click to predict properties on the Chemicalize site


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