ChemSpider 2D Image | Methyl alpha-glutamyl-S-[(2S)-2-hydroxypropanoyl]cysteinylglycinate | C14H23N3O8S

Methyl α-glutamyl-S-[(2S)-2-hydroxypropanoyl]cysteinylglycinate

  • Molecular FormulaC14H23N3O8S
  • Average mass393.413 Da
  • Monoisotopic mass393.120575 Da
  • ChemSpider ID68024256

  • defined stereocentres - 1 of 3 defined stereocentres

More details:

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

Glycine, α-glutamyl-S-[(2S)-2-hydroxy-1-oxopropyl]cysteinyl-, methyl ester [ACD/Index Name]
Methyl α-glutamyl-S-[(2S)-2-hydroxypropanoyl]cysteinylglycinate [ACD/IUPAC Name]
Methylalpha-glutamyl-S-[(2S)-2-hydroxypropanoyl]cysteinylglycinat [German] [ACD/IUPAC Name]
α-Glutamyl-S-[(2S)-2-hydroxypropanoyl]cystéinylglycinate de méthyle [French] [ACD/IUPAC Name]
Glutathione glycylmethyl ester

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

Density: 1.4±0.1 g/cm3
Boiling Point: 714.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.2 mmHg at 25°C
Enthalpy of Vaporization: 119.3±6.0 kJ/mol
Flash Point: 385.7±32.9 °C
Index of Refraction: 1.552
Molar Refractivity: 90.5±0.3 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: -0.43
ACD/LogD (pH 5.5): -3.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.64
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 210 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 62.4±3.0 dyne/cm
Molar Volume: 283.0±3.0 cm3

Click to predict properties on the Chemicalize site


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