ChemSpider 2D Image | L-Lysyl-3-{[(2E)-4-methoxy-4-oxo-2-butenoyl]amino}-D-alanine | C14H24N4O6

L-Lysyl-3-{[(2E)-4-methoxy-4-oxo-2-butenoyl]amino}-D-alanine

  • Molecular FormulaC14H24N4O6
  • Average mass344.364 Da
  • Monoisotopic mass344.169586 Da
  • ChemSpider ID23142184

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

D-Alanine, L-lysyl-3-[[(2E)-4-methoxy-1,4-dioxo-2-buten-1-yl]amino]- [ACD/Index Name]
L-Lysyl-3-{[(2E)-4-methoxy-4-oxo-2-butenoyl]amino}-D-alanin [German] [ACD/IUPAC Name]
L-Lysyl-3-{[(2E)-4-methoxy-4-oxo-2-butenoyl]amino}-D-alanine [ACD/IUPAC Name]
L-Lysyl-3-{[(2E)-4-méthoxy-4-oxo-2-butenoyl]amino}-D-alanine [French] [ACD/IUPAC Name]
3-[2-Carboxy-2-(2,6-diamino-hexanoylamino)-ethylcarbamoyl]-acrylic acid methyl ester (Lys-FMDP)

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

Density: 1.3±0.1 g/cm3
Boiling Point: 703.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 112.2±6.0 kJ/mol
Flash Point: 379.3±32.9 °C
Index of Refraction: 1.536
Molar Refractivity: 84.5±0.3 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: -2.31
ACD/LogD (pH 5.5): -5.86
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 174 Å2
Polarizability: 33.5±0.5 10-24cm3
Surface Tension: 55.9±3.0 dyne/cm
Molar Volume: 271.3±3.0 cm3

Click to predict properties on the Chemicalize site


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