ChemSpider 2D Image | 1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-oxo-D-proline | C10H15NO5

1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-oxo-D-proline

  • Molecular FormulaC10H15NO5
  • Average mass229.230 Da
  • Monoisotopic mass229.095016 Da
  • ChemSpider ID21108008

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(R)-4-Oxo-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester
1,2-Pyrrolidinedicarboxylic acid, 4-oxo-, 1-(1,1-dimethylethyl) ester, (2R)- [ACD/Index Name]
1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-oxo-D-prolin [German] [ACD/IUPAC Name]
1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-oxo-D-proline [ACD/IUPAC Name]
1-{[(2-Méthyl-2-propanyl)oxy]carbonyl}-4-oxo-D-proline [French] [ACD/IUPAC Name]
14485016 [Beilstein]
364077-84-9 [RN]
T5N CVTJ AVOX1&1&1 EVQ &&R or D Form [WLN]
(2R)-1-(TERT-BUTOXYCARBONYL)-4-OXOPYRROLIDINE-2-CARBOXYLIC ACID
(2R)-1-[(TERT-BUTOXY)CARBONYL]-4-OXOPYRROLIDINE-2-CARBOXYLIC ACID
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 390.8±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 70.3±6.0 kJ/mol
    Flash Point: 190.1±27.9 °C
    Index of Refraction: 1.516
    Molar Refractivity: 53.1±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: -0.44
    ACD/LogD (pH 5.5): -1.89
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.57
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 84 Å2
    Polarizability: 21.0±0.5 10-24cm3
    Surface Tension: 53.1±3.0 dyne/cm
    Molar Volume: 175.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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