ChemSpider 2D Image | 9-Phenyl-1,9-diazabicyclo[4.3.1]dec-6-en-2-one | C14H16N2O

9-Phenyl-1,9-diazabicyclo[4.3.1]dec-6-en-2-one

  • Molecular FormulaC14H16N2O
  • Average mass228.290 Da
  • Monoisotopic mass228.126266 Da
  • ChemSpider ID30658840

More details:

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

1,9-Diazabicyclo[4.3.1]dec-6-en-2-one, 9-phenyl- [ACD/Index Name]
9-Phenyl-1,9-diazabicyclo[4.3.1]dec-6-en-2-on [German] [ACD/IUPAC Name]
9-Phenyl-1,9-diazabicyclo[4.3.1]dec-6-en-2-one [ACD/IUPAC Name]
9-Phényl-1,9-diazabicyclo[4.3.1]déc-6-én-2-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: 361.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.8±3.0 kJ/mol
Flash Point: 157.3±21.1 °C
Index of Refraction: 1.638
Molar Refractivity: 67.3±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.95
ACD/LogD (pH 5.5): 1.44
ACD/BCF (pH 5.5): 7.36
ACD/KOC (pH 5.5): 145.17
ACD/LogD (pH 7.4): 1.45
ACD/BCF (pH 7.4): 7.38
ACD/KOC (pH 7.4): 145.53
Polar Surface Area: 24 Å2
Polarizability: 26.7±0.5 10-24cm3
Surface Tension: 53.8±5.0 dyne/cm
Molar Volume: 187.2±5.0 cm3

Click to predict properties on the Chemicalize site


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