ChemSpider 2D Image | 2,2-Dimethyl-5-[1-(3-methylphenyl)ethylidene]-1,3-dioxane-4,6-dione | C15H16O4

2,2-Dimethyl-5-[1-(3-methylphenyl)ethylidene]-1,3-dioxane-4,6-dione

  • Molecular FormulaC15H16O4
  • Average mass260.285 Da
  • Monoisotopic mass260.104858 Da
  • ChemSpider ID30659076

More details:

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

1,3-Dioxane-4,6-dione, 2,2-dimethyl-5-[1-(3-methylphenyl)ethylidene]- [ACD/Index Name]
2,2-Dimethyl-5-[1-(3-methylphenyl)ethyliden]-1,3-dioxan-4,6-dion [German] [ACD/IUPAC Name]
2,2-Dimethyl-5-[1-(3-methylphenyl)ethylidene]-1,3-dioxane-4,6-dione [ACD/IUPAC Name]
2,2-Diméthyl-5-[1-(3-méthylphényl)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: 1.2±0.1 g/cm3
Boiling Point: 479.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.4±3.0 kJ/mol
Flash Point: 251.2±27.1 °C
Index of Refraction: 1.538
Molar Refractivity: 70.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.88
ACD/LogD (pH 5.5): 2.37
ACD/BCF (pH 5.5): 37.03
ACD/KOC (pH 5.5): 461.71
ACD/LogD (pH 7.4): 2.37
ACD/BCF (pH 7.4): 37.03
ACD/KOC (pH 7.4): 461.71
Polar Surface Area: 53 Å2
Polarizability: 27.7±0.5 10-24cm3
Surface Tension: 39.3±3.0 dyne/cm
Molar Volume: 223.9±3.0 cm3

Click to predict properties on the Chemicalize site


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