ChemSpider 2D Image | 5-[1-Hydroxy-2-(2-nitrophenyl)ethylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione | C14H13NO7

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

  • Molecular FormulaC14H13NO7
  • Average mass307.255 Da
  • Monoisotopic mass307.069214 Da
  • ChemSpider ID58543447

More details:

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

1,3-Dioxane-4,6-dione, 5-[1-hydroxy-2-(2-nitrophenyl)ethylidene]-2,2-dimethyl- [ACD/Index Name]
5-[1-Hydroxy-2-(2-nitrophenyl)ethyliden]-2,2-dimethyl-1,3-dioxan-4,6-dion [German] [ACD/IUPAC Name]
5-[1-Hydroxy-2-(2-nitrophenyl)ethylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione [ACD/IUPAC Name]
5-[1-Hydroxy-2-(2-nitrophényl)éthylidène]-2,2-diméthyl-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: 1.4±0.1 g/cm3
Boiling Point: 560.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.7±3.0 kJ/mol
Flash Point: 292.6±30.1 °C
Index of Refraction: 1.590
Molar Refractivity: 72.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.57
ACD/LogD (pH 5.5): 1.14
ACD/BCF (pH 5.5): 4.21
ACD/KOC (pH 5.5): 93.48
ACD/LogD (pH 7.4): 0.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.28
Polar Surface Area: 119 Å2
Polarizability: 28.8±0.5 10-24cm3
Surface Tension: 58.7±3.0 dyne/cm
Molar Volume: 215.4±3.0 cm3

Click to predict properties on the Chemicalize site


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