ChemSpider 2D Image | (7aS)-7a-Methoxyhexahydro-3H-pyrrolizin-3-one | C8H13NO2

(7aS)-7a-Methoxyhexahydro-3H-pyrrolizin-3-one

  • Molecular FormulaC8H13NO2
  • Average mass155.194 Da
  • Monoisotopic mass155.094635 Da
  • ChemSpider ID113608382

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(7aS)-7a-Methoxyhexahydro-3H-pyrrolizin-3-on [German] [ACD/IUPAC Name]
(7aS)-7a-Methoxyhexahydro-3H-pyrrolizin-3-one [ACD/IUPAC Name]
(7aS)-7a-Méthoxyhexahydro-3H-pyrrolizin-3-one [French] [ACD/IUPAC Name]
3H-Pyrrolizin-3-one, hexahydro-7a-methoxy-, (7aS)- [ACD/Index 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: 257.4±19.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.5±3.0 kJ/mol
Flash Point: 109.5±21.5 °C
Index of Refraction: 1.520
Molar Refractivity: 40.7±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.13
ACD/LogD (pH 5.5): -0.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 22.60
ACD/LogD (pH 7.4): -0.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 22.60
Polar Surface Area: 30 Å2
Polarizability: 16.2±0.5 10-24cm3
Surface Tension: 41.2±5.0 dyne/cm
Molar Volume: 134.0±5.0 cm3

Click to predict properties on the Chemicalize site


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