ChemSpider 2D Image | Ethyl (1R,5R)-3-azabicyclo[3.1.0]hexane-1-carboxylate | C8H13NO2

Ethyl (1R,5R)-3-azabicyclo[3.1.0]hexane-1-carboxylate

  • Molecular FormulaC8H13NO2
  • Average mass155.194 Da
  • Monoisotopic mass155.094635 Da
  • ChemSpider ID61417290

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1R,5R)-3-Azabicyclo[3.1.0]hexane-1-carboxylate d'éthyle [French] [ACD/IUPAC Name]
3-Azabicyclo[3.1.0]hexane-1-carboxylic acid, ethyl ester, (1R,5R)- [ACD/Index Name]
Ethyl (1R,5R)-3-azabicyclo[3.1.0]hexane-1-carboxylate [ACD/IUPAC Name]
Ethyl-(1R,5R)-3-azabicyclo[3.1.0]hexan-1-carboxylat [German] [ACD/IUPAC Name]
1204820-73-4 [RN]
MFCD30205199
rac-ethyl (1R,5R)-3-azabicyclo[3.1.0]hexane-1-carboxylate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 203.9±23.0 °C at 760 mmHg
Vapour Pressure: 0.3±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.0±3.0 kJ/mol
Flash Point: 77.1±22.6 °C
Index of Refraction: 1.515
Molar Refractivity: 39.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.36
ACD/LogD (pH 5.5): -2.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 38 Å2
Polarizability: 15.8±0.5 10-24cm3
Surface Tension: 43.2±3.0 dyne/cm
Molar Volume: 132.4±3.0 cm3

Click to predict properties on the Chemicalize site


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