ChemSpider 2D Image | (2S,4S)-dibenzyl 4-hydroxypyrrolidine-1,2-dicarboxylate | C20H21NO5

(2S,4S)-dibenzyl 4-hydroxypyrrolidine-1,2-dicarboxylate

  • Molecular FormulaC20H21NO5
  • Average mass355.384 Da
  • Monoisotopic mass355.141968 Da
  • ChemSpider ID24609029

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,4S)-4-Hydroxy-1,2-pyrrolidinedicarboxylate de dibenzyle [French] [ACD/IUPAC Name]
(2S,4S)-dibenzyl 4-hydroxypyrrolidine-1,2-dicarboxylate
1,2-Pyrrolidinedicarboxylic acid, 4-hydroxy-, bis(phenylmethyl) ester, (2S,4S)- [ACD/Index Name]
132592-07-5 [RN]
Dibenzyl (2S,4S)-4-hydroxy-1,2-pyrrolidinedicarboxylate [ACD/IUPAC Name]
Dibenzyl-(2S,4S)-4-hydroxy-1,2-pyrrolidindicarboxylat [German] [ACD/IUPAC Name]
(2S,4S)-4-hydroxy-1,2-Pyrrolidinedicarboxylic acid 1,2-bis(phenylmethyl) ester
(2S,4S)-Dibenzyl 4-Hydroxypyrrolidine-1,2-Dicarboxylate (en)
(2s,4s)-dibenzyl4-hydroxypyrrolidine-1,2-dicarboxylate
(2S,4S)-Dibenzyl-4-hydroxypyrrolidine-1,2-dicarboxylate
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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: 517.9±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 83.2±3.0 kJ/mol
    Flash Point: 267.0±30.1 °C
    Index of Refraction: 1.608
    Molar Refractivity: 94.5±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 2.17
    ACD/LogD (pH 5.5): 3.01
    ACD/BCF (pH 5.5): 113.14
    ACD/KOC (pH 5.5): 1027.08
    ACD/LogD (pH 7.4): 3.01
    ACD/BCF (pH 7.4): 113.14
    ACD/KOC (pH 7.4): 1027.08
    Polar Surface Area: 76 Å2
    Polarizability: 37.5±0.5 10-24cm3
    Surface Tension: 59.3±3.0 dyne/cm
    Molar Volume: 273.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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