ChemSpider 2D Image | Methyl 1-[(benzyloxy)carbonyl]-D-prolyl-L-alaninate | C17H22N2O5

Methyl 1-[(benzyloxy)carbonyl]-D-prolyl-L-alaninate

  • Molecular FormulaC17H22N2O5
  • Average mass334.367 Da
  • Monoisotopic mass334.152863 Da
  • ChemSpider ID25008448

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-[(Benzyloxy)carbonyl]-D-prolyl-L-alaninate de méthyle [French] [ACD/IUPAC Name]
L-Alanine, 1-[(phenylmethoxy)carbonyl]-D-prolyl-, methyl ester [ACD/Index Name]
Methyl 1-[(benzyloxy)carbonyl]-D-prolyl-L-alaninate [ACD/IUPAC Name]
Methyl-1-[(benzyloxy)carbonyl]-D-prolyl-L-alaninat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 512.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.4±3.0 kJ/mol
Flash Point: 263.8±30.1 °C
Index of Refraction: 1.545
Molar Refractivity: 85.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.91
ACD/LogD (pH 5.5): 1.77
ACD/BCF (pH 5.5): 13.04
ACD/KOC (pH 5.5): 218.76
ACD/LogD (pH 7.4): 1.77
ACD/BCF (pH 7.4): 13.04
ACD/KOC (pH 7.4): 218.76
Polar Surface Area: 85 Å2
Polarizability: 34.0±0.5 10-24cm3
Surface Tension: 49.9±3.0 dyne/cm
Molar Volume: 271.5±3.0 cm3

Click to predict properties on the Chemicalize site


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