ChemSpider 2D Image | 5-Hydroxy-2,2-dimethyl-2,3-dihydro-3-furanyl 3,5-dinitrobenzoate | C13H12N2O8

5-Hydroxy-2,2-dimethyl-2,3-dihydro-3-furanyl 3,5-dinitrobenzoate

  • Molecular FormulaC13H12N2O8
  • Average mass324.243 Da
  • Monoisotopic mass324.059357 Da
  • ChemSpider ID95705139

More details:

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

2,4-Furandiol, 4,5-dihydro-5,5-dimethyl-, 4-(3,5-dinitrobenzoate) [ACD/Index Name]
3,5-Dinitrobenzoate de 5-hydroxy-2,2-diméthyl-2,3-dihydro-3-furanyle [French] [ACD/IUPAC Name]
5-Hydroxy-2,2-dimethyl-2,3-dihydro-3-furanyl 3,5-dinitrobenzoate [ACD/IUPAC Name]
5-Hydroxy-2,2-dimethyl-2,3-dihydro-3-furanyl-3,5-dinitrobenzoat [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 502.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.3±3.0 kJ/mol
Flash Point: 257.9±30.1 °C
Index of Refraction: 1.621
Molar Refractivity: 74.0±0.4 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 2.46
ACD/LogD (pH 5.5): 1.91
ACD/BCF (pH 5.5): 16.63
ACD/KOC (pH 5.5): 260.34
ACD/LogD (pH 7.4): 1.91
ACD/BCF (pH 7.4): 16.55
ACD/KOC (pH 7.4): 259.02
Polar Surface Area: 147 Å2
Polarizability: 29.3±0.5 10-24cm3
Surface Tension: 70.6±5.0 dyne/cm
Molar Volume: 210.3±5.0 cm3

Click to predict properties on the Chemicalize site


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