ChemSpider 2D Image | (3aR,6aR)-Octahydrocyclopenta[b]pyrrole-2-carboxylic acid | C8H13NO2

(3aR,6aR)-Octahydrocyclopenta[b]pyrrole-2-carboxylic acid

  • Molecular FormulaC8H13NO2
  • Average mass155.194 Da
  • Monoisotopic mass155.094635 Da
  • ChemSpider ID18552444

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

(3aR,6aR)-Octahydrocyclopenta[b]pyrrol-2-carbonsäure [German] [ACD/IUPAC Name]
(3aR,6aR)-Octahydrocyclopenta[b]pyrrole-2-carboxylic acid [ACD/IUPAC Name]
Acide (3aR,6aR)-octahydrocyclopenta[b]pyrrole-2-carboxylique [French] [ACD/IUPAC Name]
Cyclopenta[b]pyrrole-2-carboxylic acid, octahydro-, (3aR,6aR)- [ACD/Index Name]
(3Ar,6aR)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[b]pyrrole-2-carboxylic acid
(R)-Endo-cis-2-azabicyclo[3,3,0]octane-3-carboxylic acid
105307-53-7 [RN]
cis, Endo-octahydrocyclopenta[b]pyrrole-2-carboxylic acid

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

Density: 1.2±0.1 g/cm3
Boiling Point: 304.3±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 59.9±6.0 kJ/mol
Flash Point: 137.9±23.2 °C
Index of Refraction: 1.518
Molar Refractivity: 39.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.42
ACD/LogD (pH 5.5): -1.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.57
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 49 Å2
Polarizability: 15.8±0.5 10-24cm3
Surface Tension: 42.8±3.0 dyne/cm
Molar Volume: 131.2±3.0 cm3

Click to predict properties on the Chemicalize site


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