ChemSpider 2D Image | 2-Methyl 1-(2-methyl-2-propanyl) (4S)-4-hydroxy-1,2-pyrrolidinedicarboxylate | C11H19NO5

2-Methyl 1-(2-methyl-2-propanyl) (4S)-4-hydroxy-1,2-pyrrolidinedicarboxylate

  • Molecular FormulaC11H19NO5
  • Average mass245.272 Da
  • Monoisotopic mass245.126328 Da
  • ChemSpider ID34212166

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(4S)-4-Hydroxy-1,2-pyrrolidinedicarboxylate de 2-méthyle et de 1-(2-méthyl-2-propanyle) [French] [ACD/IUPAC Name]
1,2-Pyrrolidinedicarboxylic acid, 4-hydroxy-, 1-(1,1-dimethylethyl) 2-methyl ester, (4S)- [ACD/Index Name]
2-Methyl 1-(2-methyl-2-propanyl) (4S)-4-hydroxy-1,2-pyrrolidinedicarboxylate [ACD/IUPAC Name]
2-Methyl-1-(2-methyl-2-propanyl)-(4S)-4-hydroxy-1,2-pyrrolidindicarboxylat [German] [ACD/IUPAC Name]
1-tert-butyl 2-methyl (4S)-4-hydroxypyrrolidine-1,2-dicarboxylate
MFCD27500715

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

Density: 1.2±0.1 g/cm3
Boiling Point: 335.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 67.0±6.0 kJ/mol
Flash Point: 156.6±27.9 °C
Index of Refraction: 1.501
Molar Refractivity: 59.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.25
ACD/LogD (pH 5.5): 0.61
ACD/BCF (pH 5.5): 1.72
ACD/KOC (pH 5.5): 51.37
ACD/LogD (pH 7.4): 0.61
ACD/BCF (pH 7.4): 1.72
ACD/KOC (pH 7.4): 51.37
Polar Surface Area: 76 Å2
Polarizability: 23.5±0.5 10-24cm3
Surface Tension: 46.9±3.0 dyne/cm
Molar Volume: 201.6±3.0 cm3

Click to predict properties on the Chemicalize site


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