ChemSpider 2D Image | 5-[1-(3-Chlorophenyl)ethylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione | C14H13ClO4

5-[1-(3-Chlorophenyl)ethylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione

  • Molecular FormulaC14H13ClO4
  • Average mass280.704 Da
  • Monoisotopic mass280.050232 Da
  • ChemSpider ID30659075

More details:

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

1,3-Dioxane-4,6-dione, 5-[1-(3-chlorophenyl)ethylidene]-2,2-dimethyl- [ACD/Index Name]
5-[1-(3-Chlorophenyl)ethylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione [ACD/IUPAC Name]
5-[1-(3-Chlorophényl)éthylidène]-2,2-diméthyl-1,3-dioxane-4,6-dione [French] [ACD/IUPAC Name]
5-[1-(3-Chlorphenyl)ethyliden]-2,2-dimethyl-1,3-dioxan-4,6-dion [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 504.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.5±3.0 kJ/mol
Flash Point: 214.6±29.1 °C
Index of Refraction: 1.551
Molar Refractivity: 70.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.02
ACD/LogD (pH 5.5): 2.64
ACD/BCF (pH 5.5): 59.72
ACD/KOC (pH 5.5): 650.04
ACD/LogD (pH 7.4): 2.64
ACD/BCF (pH 7.4): 59.72
ACD/KOC (pH 7.4): 650.04
Polar Surface Area: 53 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 42.1±3.0 dyne/cm
Molar Volume: 219.6±3.0 cm3

Click to predict properties on the Chemicalize site


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