ChemSpider 2D Image | Methyl N-{[3-(1-methyl-1H-imidazol-3-ium-3-yl)propyl]carbamoyl}-L-phenylalaninate | C18H25N4O3

Methyl N-{[3-(1-methyl-1H-imidazol-3-ium-3-yl)propyl]carbamoyl}-L-phenylalaninate

  • Molecular FormulaC18H25N4O3
  • Average mass345.416 Da
  • Monoisotopic mass345.192108 Da
  • ChemSpider ID77408913

  • Charge - Charge

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

L-Phenylalanine, N-[[[3-(1-methyl-1H-imidazolium-3-yl)propyl]amino]carbonyl]-, methyl ester [ACD/Index Name]
Methyl N-{[3-(1-methyl-1H-imidazol-3-ium-3-yl)propyl]carbamoyl}-L-phenylalaninate [ACD/IUPAC Name]
Methyl-N-{[3-(1-methyl-1H-imidazol-3-ium-3-yl)propyl]carbamoyl}-L-phenylalaninat [German] [ACD/IUPAC Name]
N-{[3-(1-Méthyl-1H-imidazol-3-ium-3-yl)propyl]carbamoyl}-L-phénylalaninate de méthyle [French] [ACD/IUPAC Name]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 76 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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