ChemSpider 2D Image | Methyl N-{[(2-methyl-2-propanyl)oxy]carbonyl}leucylvalyl-2-methylalaninate | C21H39N3O6

Methyl N-{[(2-methyl-2-propanyl)oxy]carbonyl}leucylvalyl-2-methylalaninate

  • Molecular FormulaC21H39N3O6
  • Average mass429.551 Da
  • Monoisotopic mass429.283875 Da
  • ChemSpider ID26667028

More details:

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

Alanine, N-[(1,1-dimethylethoxy)carbonyl]leucylvalyl-2-methyl-, methyl ester [ACD/Index Name]
Methyl N-{[(2-methyl-2-propanyl)oxy]carbonyl}leucylvalyl-2-methylalaninate [ACD/IUPAC Name]
Methyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}leucylvalyl-2-methylalaninat [German] [ACD/IUPAC Name]
N-{[(2-Méthyl-2-propanyl)oxy]carbonyl}leucylvalyl-2-méthylalaninate de méthyle [French] [ACD/IUPAC Name]
Boc-Leu-Val-Aib-OMe

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

Density: 1.1±0.1 g/cm3
Boiling Point: 593.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.4±3.0 kJ/mol
Flash Point: 312.5±27.3 °C
Index of Refraction: 1.473
Molar Refractivity: 113.5±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 3.76
ACD/LogD (pH 5.5): 3.15
ACD/BCF (pH 5.5): 146.45
ACD/KOC (pH 5.5): 1235.37
ACD/LogD (pH 7.4): 3.15
ACD/BCF (pH 7.4): 146.41
ACD/KOC (pH 7.4): 1235.07
Polar Surface Area: 123 Å2
Polarizability: 45.0±0.5 10-24cm3
Surface Tension: 36.0±3.0 dyne/cm
Molar Volume: 404.4±3.0 cm3

Click to predict properties on the Chemicalize site


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