ChemSpider 2D Image | N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-beta-alanyl-N-[2-(dimethylamino)ethyl]alaninamide | C15H30N4O4

N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-β-alanyl-N-[2-(dimethylamino)ethyl]alaninamide

  • Molecular FormulaC15H30N4O4
  • Average mass330.423 Da
  • Monoisotopic mass330.226715 Da
  • ChemSpider ID65055641

More details:

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

Alaninamide, N-[(1,1-dimethylethoxy)carbonyl]-β-alanyl-N-[2-(dimethylamino)ethyl]- [ACD/Index Name]
N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-β-alanyl-N-[2-(dimethylamino)ethyl]alaninamid [German] [ACD/IUPAC Name]
N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-β-alanyl-N-[2-(dimethylamino)ethyl]alaninamide [ACD/IUPAC Name]
N-{[(2-Méthyl-2-propanyl)oxy]carbonyl}-β-alanyl-N-[2-(diméthylamino)éthyl]alaninamide [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 564.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.8±3.0 kJ/mol
Flash Point: 295.0±28.7 °C
Index of Refraction: 1.482
Molar Refractivity: 87.8±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 0.17
ACD/LogD (pH 5.5): -2.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.20
Polar Surface Area: 100 Å2
Polarizability: 34.8±0.5 10-24cm3
Surface Tension: 38.2±3.0 dyne/cm
Molar Volume: 308.0±3.0 cm3

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