ChemSpider 2D Image | 6-Oxa-1-azabicyclo[3.1.0]hexa-2,4-diene | C4H3NO

6-Oxa-1-azabicyclo[3.1.0]hexa-2,4-diene

  • Molecular FormulaC4H3NO
  • Average mass81.073 Da
  • Monoisotopic mass81.021461 Da
  • ChemSpider ID67157546

More details:

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

6-Oxa-1-azabicyclo[3.1.0]hexa-2,4-dien [German] [ACD/IUPAC Name]
6-Oxa-1-azabicyclo[3.1.0]hexa-2,4-diene [ACD/Index Name] [ACD/IUPAC Name]
6-Oxa-1-azabicyclo[3.1.0]hexa-2,4-diène [French] [ACD/IUPAC Name]
pyrrolether

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

Density: 1.4±0.1 g/cm3
Boiling Point: 171.6±23.0 °C at 760 mmHg
Vapour Pressure: 1.4±0.3 mmHg at 25°C
Enthalpy of Vaporization: 40.8±3.0 kJ/mol
Flash Point: 57.6±22.6 °C
Index of Refraction: 1.674
Molar Refractivity: 21.2±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.52
ACD/LogD (pH 5.5): 1.02
ACD/BCF (pH 5.5): 3.53
ACD/KOC (pH 5.5): 85.88
ACD/LogD (pH 7.4): 1.02
ACD/BCF (pH 7.4): 3.53
ACD/KOC (pH 7.4): 85.88
Polar Surface Area: 17 Å2
Polarizability: 8.4±0.5 10-24cm3
Surface Tension: 52.9±7.0 dyne/cm
Molar Volume: 56.5±7.0 cm3

Click to predict properties on the Chemicalize site


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