ChemSpider 2D Image | (2R,4R)-Benzyl 4-hydroxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate | C13H17NO4

(2R,4R)-Benzyl 4-hydroxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate

  • Molecular FormulaC13H17NO4
  • Average mass251.278 Da
  • Monoisotopic mass251.115753 Da
  • ChemSpider ID29784530

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,4R)-4-Hydroxy-2-(hydroxyméthyl)-1-pyrrolidinecarboxylate de benzyle [French] [ACD/IUPAC Name]
(2R,4R)-Benzyl 4-hydroxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate
1009335-39-0 [RN]
1-Pyrrolidinecarboxylic acid, 4-hydroxy-2-(hydroxymethyl)-, phenylmethyl ester, (2R,4R)- [ACD/Index Name]
Benzyl (2R,4R)-4-hydroxy-2-(hydroxymethyl)-1-pyrrolidinecarboxylate [ACD/IUPAC Name]
Benzyl-(2R,4R)-4-hydroxy-2-(hydroxymethyl)-1-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
(2r,4r) -phenyl-4-hydroxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate
(2r,4r)-benzyl 4-hydroxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate???ws203571???
benzyl (2R,4R)-4-hydroxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate
cis-Benzyl 4-hydroxy-2-(hydroxymethyl)pyrrolidine-1-carboxylate
More...

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 433.9±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 72.7±3.0 kJ/mol
    Flash Point: 216.2±27.3 °C
    Index of Refraction: 1.589
    Molar Refractivity: 65.3±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: -0.22
    ACD/LogD (pH 5.5): 0.69
    ACD/BCF (pH 5.5): 1.96
    ACD/KOC (pH 5.5): 56.43
    ACD/LogD (pH 7.4): 0.69
    ACD/BCF (pH 7.4): 1.96
    ACD/KOC (pH 7.4): 56.43
    Polar Surface Area: 70 Å2
    Polarizability: 25.9±0.5 10-24cm3
    Surface Tension: 58.9±3.0 dyne/cm
    Molar Volume: 193.6±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement