ChemSpider 2D Image | Methyl L-phenylalanylphenylalaninate | C19H22N2O3

Methyl L-phenylalanylphenylalaninate

  • Molecular FormulaC19H22N2O3
  • Average mass326.390 Da
  • Monoisotopic mass326.163055 Da
  • ChemSpider ID64158869

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

L-Phénylalanylphénylalaninate de méthyle [French] [ACD/IUPAC Name]
Methyl L-phenylalanylphenylalaninate [ACD/IUPAC Name]
MethylL-phenylalanylphenylalaninat [German] [ACD/IUPAC Name]
Phenylalanine, L-phenylalanyl-, methyl ester [ACD/Index 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: 533.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.0±3.0 kJ/mol
Flash Point: 276.6±30.1 °C
Index of Refraction: 1.575
Molar Refractivity: 92.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.78
ACD/LogD (pH 5.5): 1.11
ACD/BCF (pH 5.5): 2.16
ACD/KOC (pH 5.5): 28.30
ACD/LogD (pH 7.4): 2.20
ACD/BCF (pH 7.4): 26.61
ACD/KOC (pH 7.4): 348.55
Polar Surface Area: 81 Å2
Polarizability: 36.6±0.5 10-24cm3
Surface Tension: 48.3±3.0 dyne/cm
Molar Volume: 279.3±3.0 cm3

Click to predict properties on the Chemicalize site


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