ChemSpider 2D Image | Diisopropyl 3-[(E)-2-(3,4-dimethoxyphenyl)vinyl]-5-oxo-3-cyclohexene-1,1-dicarboxylate | C24H30O7

Diisopropyl 3-[(E)-2-(3,4-dimethoxyphenyl)vinyl]-5-oxo-3-cyclohexene-1,1-dicarboxylate

  • Molecular FormulaC24H30O7
  • Average mass430.491 Da
  • Monoisotopic mass430.199158 Da
  • ChemSpider ID24742260

  • Double-bond stereo - Double-bond stereo

More details:

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

3-[(E)-2-(3,4-Diméthoxyphényl)vinyl]-5-oxo-3-cyclohexène-1,1-dicarboxylate de diisopropyle [French] [ACD/IUPAC Name]
3-Cyclohexene-1,1-dicarboxylic acid, 3-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-oxo-, bis(1-methylethyl) ester [ACD/Index Name]
Diisopropyl 3-[(E)-2-(3,4-dimethoxyphenyl)vinyl]-5-oxo-3-cyclohexene-1,1-dicarboxylate [ACD/IUPAC Name]
Diisopropyl-3-[(E)-2-(3,4-dimethoxyphenyl)vinyl]-5-oxo-3-cyclohexen-1,1-dicarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 537.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.5±3.0 kJ/mol
Flash Point: 230.0±30.2 °C
Index of Refraction: 1.569
Molar Refractivity: 118.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.80
ACD/LogD (pH 5.5): 3.40
ACD/BCF (pH 5.5): 225.08
ACD/KOC (pH 5.5): 1680.38
ACD/LogD (pH 7.4): 3.40
ACD/BCF (pH 7.4): 225.08
ACD/KOC (pH 7.4): 1680.38
Polar Surface Area: 88 Å2
Polarizability: 46.9±0.5 10-24cm3
Surface Tension: 48.5±3.0 dyne/cm
Molar Volume: 360.8±3.0 cm3

Click to predict properties on the Chemicalize site


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