ChemSpider 2D Image | 3-Acetoxy-1-azoniabicyclo[2.2.2]octane | C9H16NO2

3-Acetoxy-1-azoniabicyclo[2.2.2]octane

  • Molecular FormulaC9H16NO2
  • Average mass170.228 Da
  • Monoisotopic mass170.117554 Da
  • ChemSpider ID77408651

  • Charge - Charge

More details:

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

1-Azabicyclo[2.2.2]octan-3-ol, acetate (ester), conjugate acid [ACD/Index Name]
3-Acetoxy-1-azoniabicyclo[2.2.2]octan [German] [ACD/IUPAC Name]
3-Acetoxy-1-azoniabicyclo[2.2.2]octane [ACD/IUPAC Name]
3-Acétoxy-1-azoniabicyclo[2.2.2]octane [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 221.5±23.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 45.8±3.0 kJ/mol
Flash Point: 85.0±13.5 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.43
ACD/LogD (pH 5.5): -1.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.44
Polar Surface Area: 31 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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