ChemSpider 2D Image | N-[(2S,7aR)-3-Oxohexahydro-1H-pyrrolizin-2-yl]benzamide | C14H16N2O2

N-[(2S,7aR)-3-Oxohexahydro-1H-pyrrolizin-2-yl]benzamide

  • Molecular FormulaC14H16N2O2
  • Average mass244.289 Da
  • Monoisotopic mass244.121185 Da
  • ChemSpider ID30658647

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Benzamide, N-[(2S,7aR)-hexahydro-3-oxo-1H-pyrrolizin-2-yl]- [ACD/Index Name]
N-[(2S,7aR)-3-Oxohexahydro-1H-pyrrolizin-2-yl]benzamid [German] [ACD/IUPAC Name]
N-[(2S,7aR)-3-Oxohexahydro-1H-pyrrolizin-2-yl]benzamide [ACD/IUPAC Name]
N-[(2S,7aR)-3-Oxohexahydro-1H-pyrrolizin-2-yl]benzamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 512.0±29.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.3±3.0 kJ/mol
Flash Point: 263.5±24.3 °C
Index of Refraction: 1.614
Molar Refractivity: 67.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.12
ACD/LogD (pH 5.5): 1.28
ACD/BCF (pH 5.5): 5.52
ACD/KOC (pH 5.5): 118.17
ACD/LogD (pH 7.4): 1.28
ACD/BCF (pH 7.4): 5.52
ACD/KOC (pH 7.4): 118.17
Polar Surface Area: 49 Å2
Polarizability: 26.7±0.5 10-24cm3
Surface Tension: 54.7±5.0 dyne/cm
Molar Volume: 193.4±5.0 cm3

Click to predict properties on the Chemicalize site


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