ChemSpider 2D Image | 5H-Dibenzo[b,g][1,4,6]oxadiazocin-6(7H)-one | C13H10N2O2

5H-Dibenzo[b,g][1,4,6]oxadiazocin-6(7H)-one

  • Molecular FormulaC13H10N2O2
  • Average mass226.231 Da
  • Monoisotopic mass226.074234 Da
  • ChemSpider ID24725027

More details:






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

5H-Dibenz[b,g][1,4,6]oxadiazocin-6(7H)-one [ACD/Index Name]
5H-Dibenzo[b,g][1,4,6]oxadiazocin-6(7H)-on [German] [ACD/IUPAC Name]
5H-Dibenzo[b,g][1,4,6]oxadiazocin-6(7H)-one [ACD/IUPAC Name]
5H-Dibenzo[b,g][1,4,6]oxadiazocin-6(7H)-one [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: 274.9±10.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.3±3.0 kJ/mol
Flash Point: 120.0±19.0 °C
Index of Refraction: 1.603
Molar Refractivity: 62.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.80
ACD/LogD (pH 5.5): 2.85
ACD/BCF (pH 5.5): 86.19
ACD/KOC (pH 5.5): 845.28
ACD/LogD (pH 7.4): 2.85
ACD/BCF (pH 7.4): 86.19
ACD/KOC (pH 7.4): 845.32
Polar Surface Area: 50 Å2
Polarizability: 24.7±0.5 10-24cm3
Surface Tension: 44.0±3.0 dyne/cm
Molar Volume: 181.2±3.0 cm3

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