ChemSpider 2D Image | 2,2-Dimethyl-5-{1-[3-(2-methyl-2-propanyl)phenyl]ethylidene}-1,3-dioxane-4,6-dione | C18H22O4

2,2-Dimethyl-5-{1-[3-(2-methyl-2-propanyl)phenyl]ethylidene}-1,3-dioxane-4,6-dione

  • Molecular FormulaC18H22O4
  • Average mass302.365 Da
  • Monoisotopic mass302.151794 Da
  • ChemSpider ID30659077

More details:

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

1,3-Dioxane-4,6-dione, 5-[1-[3-(1,1-dimethylethyl)phenyl]ethylidene]-2,2-dimethyl- [ACD/Index Name]
2,2-Dimethyl-5-{1-[3-(2-methyl-2-propanyl)phenyl]ethyliden}-1,3-dioxan-4,6-dion [German] [ACD/IUPAC Name]
2,2-Dimethyl-5-{1-[3-(2-methyl-2-propanyl)phenyl]ethylidene}-1,3-dioxane-4,6-dione [ACD/IUPAC Name]
2,2-Diméthyl-5-{1-[3-(2-méthyl-2-propanyl)phényl]éthylidène}-1,3-dioxane-4,6-dione [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 492.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.9±3.0 kJ/mol
Flash Point: 251.5±27.1 °C
Index of Refraction: 1.521
Molar Refractivity: 83.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.11
ACD/LogD (pH 5.5): 3.71
ACD/BCF (pH 5.5): 386.01
ACD/KOC (pH 5.5): 2472.23
ACD/LogD (pH 7.4): 3.71
ACD/BCF (pH 7.4): 386.01
ACD/KOC (pH 7.4): 2472.23
Polar Surface Area: 53 Å2
Polarizability: 33.1±0.5 10-24cm3
Surface Tension: 37.1±3.0 dyne/cm
Molar Volume: 274.3±3.0 cm3

Click to predict properties on the Chemicalize site


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