ChemSpider 2D Image | trans-4-Pentylcyclohexanecarboxylate | C12H21O2

trans-4-Pentylcyclohexanecarboxylate

  • Molecular FormulaC12H21O2
  • Average mass197.294 Da
  • Monoisotopic mass197.154709 Da
  • ChemSpider ID25936242

  • Charge - Charge

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Cyclohexanecarboxylic acid, 4-pentyl-, ion(1-), trans- [ACD/Index Name]
trans-4-Pentylcyclohexancarboxylat [German] [ACD/IUPAC Name]
trans-4-Pentylcyclohexanecarboxylate [ACD/IUPAC Name]
trans-4-Pentylcyclohexanecarboxylate [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 304.6±10.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 59.9±6.0 kJ/mol
Flash Point: 147.4±13.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.39
ACD/LogD (pH 5.5): 3.39
ACD/BCF (pH 5.5): 153.71
ACD/KOC (pH 5.5): 826.46
ACD/LogD (pH 7.4): 1.62
ACD/BCF (pH 7.4): 2.58
ACD/KOC (pH 7.4): 13.88
Polar Surface Area: 40 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


Advertisement