ChemSpider 2D Image | Methyl N-{[(2R)-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-2-azetidinyl]carbonyl}glycylglycinate | C14H23N3O6

Methyl N-{[(2R)-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-2-azetidinyl]carbonyl}glycylglycinate

  • Molecular FormulaC14H23N3O6
  • Average mass329.349 Da
  • Monoisotopic mass329.158691 Da
  • ChemSpider ID64972187
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

Glycine, N-[[(2R)-1-[(1,1-dimethylethoxy)carbonyl]-2-azetidinyl]carbonyl]glycyl-, methyl ester [ACD/Index Name]
Methyl N-{[(2R)-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-2-azetidinyl]carbonyl}glycylglycinate [ACD/IUPAC Name]
MethylN-{[(2R)-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-2-azetidinyl]carbonyl}glycylglycinat [German] [ACD/IUPAC Name]
N-{[(2R)-1-{[(2-Méthyl-2-propanyl)oxy]carbonyl}-2-azétidinyl]carbonyl}glycylglycinate de méthyle [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 553.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.4±3.0 kJ/mol
Flash Point: 288.3±30.1 °C
Index of Refraction: 1.508
Molar Refractivity: 78.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: -0.51
ACD/LogD (pH 5.5): -0.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 18.06
ACD/LogD (pH 7.4): -0.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 18.06
Polar Surface Area: 114 Å2
Polarizability: 31.3±0.5 10-24cm3
Surface Tension: 48.8±3.0 dyne/cm
Molar Volume: 264.7±3.0 cm3

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