ChemSpider 2D Image | 4-(cis-4-Butylcyclohexyl)benzoic acid | C17H24O2

4-(cis-4-Butylcyclohexyl)benzoic acid

  • Molecular FormulaC17H24O2
  • Average mass260.371 Da
  • Monoisotopic mass260.177643 Da
  • ChemSpider ID113607289

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

4-(cis-4-Butylcyclohexyl)benzoesäure [German] [ACD/IUPAC Name]
4-(cis-4-Butylcyclohexyl)benzoic acid [ACD/IUPAC Name]
Acide 4-(cis-4-butylcyclohexyl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-(cis-4-butylcyclohexyl)- [ACD/Index 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: 397.2±21.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.3±3.0 kJ/mol
Flash Point: 188.6±16.7 °C
Index of Refraction: 1.524
Molar Refractivity: 77.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 6.50
ACD/LogD (pH 5.5): 4.22
ACD/BCF (pH 5.5): 491.94
ACD/KOC (pH 5.5): 1347.59
ACD/LogD (pH 7.4): 2.61
ACD/BCF (pH 7.4): 11.96
ACD/KOC (pH 7.4): 32.76
Polar Surface Area: 37 Å2
Polarizability: 30.8±0.5 10-24cm3
Surface Tension: 40.3±3.0 dyne/cm
Molar Volume: 253.8±3.0 cm3

Click to predict properties on the Chemicalize site


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