ChemSpider 2D Image | 2,5-Oxepinedione | C6H4O3

2,5-Oxepinedione

  • Molecular FormulaC6H4O3
  • Average mass124.094 Da
  • Monoisotopic mass124.016045 Da
  • ChemSpider ID24217675

More details:

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

2,5-Oxepindion [German] [ACD/IUPAC Name]
2,5-Oxepindione [ACD/Index Name]
2,5-Oxepinedione [ACD/IUPAC Name]
2,5-Oxépinedione [French] [ACD/IUPAC Name]
"OXEPINE-2,5-DIONE"
113567-95-6 [RN]
2,5-Oxepindione (9CI)
2,5-Oxepindione(9CI)
MFCD18812569
Oxepine-2,5-dione

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

Density: 1.3±0.1 g/cm3
Boiling Point: 264.7±29.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 50.3±3.0 kJ/mol
Flash Point: 117.2±24.3 °C
Index of Refraction: 1.518
Molar Refractivity: 28.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.04
ACD/LogD (pH 5.5): -0.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 21.38
ACD/LogD (pH 7.4): -0.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 21.38
Polar Surface Area: 43 Å2
Polarizability: 11.4±0.5 10-24cm3
Surface Tension: 45.7±3.0 dyne/cm
Molar Volume: 94.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement