ChemSpider 2D Image | (2R,3R)-2-(3,4-Dimethoxyphenyl)-1-(2-methoxyethyl)-5-oxo-3-pyrrolidinecarboxylic acid | C16H21NO6

(2R,3R)-2-(3,4-Dimethoxyphenyl)-1-(2-methoxyethyl)-5-oxo-3-pyrrolidinecarboxylic acid

  • Molecular FormulaC16H21NO6
  • Average mass323.341 Da
  • Monoisotopic mass323.136902 Da
  • ChemSpider ID17920565

  • defined stereocentres - 2 of 2 defined stereocentres

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

(2R,3R)-2-(3,4-Dimethoxyphenyl)-1-(2-methoxyethyl)-5-oxo-3-pyrrolidincarbonsäure [German] [ACD/IUPAC Name]
(2R,3R)-2-(3,4-Dimethoxyphenyl)-1-(2-methoxyethyl)-5-oxo-3-pyrrolidinecarboxylic acid [ACD/IUPAC Name]
(2R,3R)-2-(3,4-dimethoxyphenyl)-1-(2-methoxyethyl)-5-oxopyrrolidine-3-carboxylic acid
1087712-85-3 [RN]
3-Pyrrolidinecarboxylic acid, 2-(3,4-dimethoxyphenyl)-1-(2-methoxyethyl)-5-oxo-, (2R,3R)- [ACD/Index Name]
Acide (2R,3R)-2-(3,4-diméthoxyphényl)-1-(2-méthoxyéthyl)-5-oxo-3-pyrrolidinecarboxylique [French] [ACD/IUPAC Name]
(2{R},3{R})-2-(3,4-dimethoxyphenyl)-1-(2-methoxyethyl)-5-oxopyrrolidine-3-carboxylic acid
(2R,3R)-2-(3,4-dimethoxyphenyl)-1-(2-methoxyethyl)-5-oxopyrrolidine-3-carboxyl ic acid
(2r,3r)-2-(3,4-dimethoxyphenyl)-1-(2-methoxyethyl)-5-oxo-pyrrolidine-3-carboxylic acid
(2R,3R)-2-(3,4-Dimethoxy-phenyl)-1-(2-methoxy-ethyl)-5-oxo-pyrrolidine-3-carboxylic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

MFCD08448724 [DBID]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 526.9±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 84.4±3.0 kJ/mol
    Flash Point: 272.5±30.1 °C
    Index of Refraction: 1.539
    Molar Refractivity: 81.8±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 0.70
    ACD/LogD (pH 5.5): -0.26
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 4.77
    ACD/LogD (pH 7.4): -2.05
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 85 Å2
    Polarizability: 32.4±0.5 10-24cm3
    Surface Tension: 46.5±3.0 dyne/cm
    Molar Volume: 261.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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