ChemSpider 2D Image | Ethyl (2E,4E,6E)-5-methyl-7-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6-heptatrienoate | C19H28O2

Ethyl (2E,4E,6E)-5-methyl-7-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6-heptatrienoate

  • Molecular FormulaC19H28O2
  • Average mass288.424 Da
  • Monoisotopic mass288.208923 Da
  • ChemSpider ID110405729

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E,4E,6E)-5-Méthyl-7-(2,6,6-triméthyl-1-cyclohexén-1-yl)-2,4,6-heptatriénoate d'éthyle [French] [ACD/IUPAC Name]
2,4,6-Heptatrienoic acid, 5-methyl-7-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, ethyl ester, (2E,4E,6E)- [ACD/Index Name]
Ethyl (2E,4E,6E)-5-methyl-7-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6-heptatrienoate [ACD/IUPAC Name]
Ethyl-(2E,4E,6E)-5-methyl-7-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6-heptatrienoat [German] [ACD/IUPAC 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: 390.5±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.0±3.0 kJ/mol
Flash Point: 204.7±10.4 °C
Index of Refraction: 1.528
Molar Refractivity: 91.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 6.78
ACD/LogD (pH 5.5): 5.88
ACD/BCF (pH 5.5): 17200.76
ACD/KOC (pH 5.5): 37444.84
ACD/LogD (pH 7.4): 5.88
ACD/BCF (pH 7.4): 17200.76
ACD/KOC (pH 7.4): 37444.84
Polar Surface Area: 26 Å2
Polarizability: 36.2±0.5 10-24cm3
Surface Tension: 35.5±3.0 dyne/cm
Molar Volume: 296.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement