ChemSpider 2D Image | (3aR,6aS)-tert-Butyl hexahydrocyclopenta[c]pyrrole-2(1H)-carboxylate | C12H21NO2

(3aR,6aS)-tert-Butyl hexahydrocyclopenta[c]pyrrole-2(1H)-carboxylate

  • Molecular FormulaC12H21NO2
  • Average mass211.301 Da
  • Monoisotopic mass211.157227 Da
  • ChemSpider ID28291089

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3aR,6aS)-Hexahydrocyclopenta[c]pyrrole-2(1H)-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
(3aR,6aS)-tert-Butyl hexahydrocyclopenta[c]pyrrole-2(1H)-carboxylate
2-Methyl-2-propanyl (3aR,6aS)-hexahydrocyclopenta[c]pyrrole-2(1H)-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(3aR,6aS)-hexahydrocyclopenta[c]pyrrol-2(1H)-carboxylat [German] [ACD/IUPAC Name]
926276-08-6 [RN]
Cyclopenta[c]pyrrole-2(1H)-carboxylic acid, hexahydro-, 1,1-dimethylethyl ester, (3aR,6aS)- [ACD/Index Name]
(3aR,6aR)-Tert-butyl hexahydropyrrolo[3,4-b]pyrrole-5(1H)-carboxylate
(3ar,6as)-rel-hexahydrocyclopenta(c)pyrrole-2(1h)-carboxylic acid tert-butyl ester
(3R*, 6S*)-hexahydrocyclopenta[c]pyrrole-2(1H)-carboxylic acid tert-butyl ester
370882-39-6 [RN]
More...

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 280.6±9.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 51.9±3.0 kJ/mol
    Flash Point: 123.5±18.7 °C
    Index of Refraction: 1.495
    Molar Refractivity: 58.7±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.48
    ACD/LogD (pH 5.5): 3.26
    ACD/BCF (pH 5.5): 176.93
    ACD/KOC (pH 5.5): 1414.43
    ACD/LogD (pH 7.4): 3.26
    ACD/BCF (pH 7.4): 176.93
    ACD/KOC (pH 7.4): 1414.43
    Polar Surface Area: 30 Å2
    Polarizability: 23.3±0.5 10-24cm3
    Surface Tension: 36.8±3.0 dyne/cm
    Molar Volume: 201.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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