ChemSpider 2D Image | (1S,3aR,6aS)-Ethyl octahydrocyclopenta[c]pyrrole-1-carboxylate | C10H17NO2

(1S,3aR,6aS)-Ethyl octahydrocyclopenta[c]pyrrole-1-carboxylate

  • Molecular FormulaC10H17NO2
  • Average mass183.247 Da
  • Monoisotopic mass183.125931 Da
  • ChemSpider ID26404094

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(1S,3aR,6aS)-Ethyl octahydrocyclopenta[c]pyrrole-1-carboxylate
(1S,3aR,6aS)-Octahydrocyclopenta[c]pyrrole-1-carboxylate d'éthyle [French] [ACD/IUPAC Name]
402958-25-2 [RN]
Cyclopenta[c]pyrrole-1-carboxylic acid, octahydro-, ethyl ester, (1S,3aR,6aS)- [ACD/Index Name]
Ethyl (1S,3aR,6aS)-octahydrocyclopenta[c]pyrrole-1-carboxylate [ACD/IUPAC Name]
Ethyl-(1S,3aR,6aS)-octahydrocyclopenta[c]pyrrol-1-carboxylat [German] [ACD/IUPAC Name]
(1S,3aR,6aS)-Ethyloctahydrocyclopenta[c]pyrrole-1-carboxylate
(1S,3aR,6aS)-Octahydro-cyclopenta[c]pyrrole-1-carboxylic acid ethyl ester
(1S,3aR,6aS)-Octahydrocyclopenta[c]pyrrole-1-carboxylic Acid Ethyl Ester
(1S,3ar,6AS)-octahydro-cyclopentac pyrrole-1-carboxylic acid, ethyl ester
More...

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 254.8±23.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 49.2±3.0 kJ/mol
    Flash Point: 107.9±22.6 °C
    Index of Refraction: 1.481
    Molar Refractivity: 49.3±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.41
    ACD/LogD (pH 5.5): -0.95
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.03
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 2.47
    Polar Surface Area: 38 Å2
    Polarizability: 19.5±0.5 10-24cm3
    Surface Tension: 34.4±3.0 dyne/cm
    Molar Volume: 173.1±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement