ChemSpider 2D Image | 1,3,3-Tris(1-methylcyclohexyl)propyl acetate | C26H46O2

1,3,3-Tris(1-methylcyclohexyl)propyl acetate

  • Molecular FormulaC26H46O2
  • Average mass390.642 Da
  • Monoisotopic mass390.349792 Da
  • ChemSpider ID21165976

More details:

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

1,3,3-Tris(1-methylcyclohexyl)propyl acetate [ACD/IUPAC Name]
1,3,3-Tris(1-methylcyclohexyl)propyl-acetat [German] [ACD/IUPAC Name]
299-845-8 [EINECS]
93917-67-0 [RN]
Acétate de 1,3,3-tris(1-méthylcyclohexyl)propyle [French] [ACD/IUPAC Name]
Cyclohexanepropanol, 1-methyl-α,γ-bis(1-methylcyclohexyl)-, acetate [ACD/Index Name]
α,γ,γ-trimethylcyclohexylpropyl acetate

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

Density: 1.0±0.1 g/cm3
Boiling Point: 411.6±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.4±3.0 kJ/mol
Flash Point: 213.9±11.1 °C
Index of Refraction: 1.486
Molar Refractivity: 117.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 10.27
ACD/LogD (pH 5.5): 8.94
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1737698.75
ACD/LogD (pH 7.4): 8.94
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1737698.75
Polar Surface Area: 26 Å2
Polarizability: 46.6±0.5 10-24cm3
Surface Tension: 34.5±3.0 dyne/cm
Molar Volume: 409.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement