ChemSpider 2D Image | Methyl N-(carboxymethyl)-N-(3-phenylpropanoyl)glycyl-D-histidinate | C20H24N4O6

Methyl N-(carboxymethyl)-N-(3-phenylpropanoyl)glycyl-D-histidinate

  • Molecular FormulaC20H24N4O6
  • Average mass416.428 Da
  • Monoisotopic mass416.169586 Da
  • ChemSpider ID35034080

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

D-Histidine, N-(carboxymethyl)-N-(1-oxo-3-phenylpropyl)glycyl-, methyl ester [ACD/Index Name]
Methyl N-(carboxymethyl)-N-(3-phenylpropanoyl)glycyl-D-histidinate [ACD/IUPAC Name]
Methyl-N-(carboxymethyl)-N-(3-phenylpropanoyl)glycyl-D-histidinat [German] [ACD/IUPAC Name]
N-(Carboxyméthyl)-N-(3-phénylpropanoyl)glycyl-D-histidinate de méthyle [French] [ACD/IUPAC Name]
mGH

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

Density: 1.3±0.1 g/cm3
Boiling Point: 772.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 118.0±3.0 kJ/mol
Flash Point: 421.1±32.9 °C
Index of Refraction: 1.590
Molar Refractivity: 105.2±0.3 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 0.56
ACD/LogD (pH 5.5): -2.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.65
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 142 Å2
Polarizability: 41.7±0.5 10-24cm3
Surface Tension: 62.1±3.0 dyne/cm
Molar Volume: 311.9±3.0 cm3

Click to predict properties on the Chemicalize site


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