ChemSpider 2D Image | Methyl N-(adamantan-1-ylcarbonyl)glycylleucyltyrosinate | C29H41N3O6

Methyl N-(adamantan-1-ylcarbonyl)glycylleucyltyrosinate

  • Molecular FormulaC29H41N3O6
  • Average mass527.652 Da
  • Monoisotopic mass527.299561 Da
  • ChemSpider ID508400

More details:

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

Methyl N-(adamantan-1-ylcarbonyl)glycylleucyltyrosinate [ACD/IUPAC Name]
MethylN-(adamantan-1-ylcarbonyl)glycylleucyltyrosinat [German] [ACD/IUPAC Name]
N-(Adamantan-1-ylcarbonyl)glycylleucyltyrosinate de méthyle [French] [ACD/IUPAC Name]
Tyrosine, N-(tricyclo[3.3.1.13,7]dec-1-ylcarbonyl)glycylleucyl-, methyl ester [ACD/Index Name]
Methyl 2-([2-(([(1-adamantylcarbonyl)amino]acetyl)amino)-4-methylpentanoyl]amino)-3-(4-hydroxyphenyl)propanoate
Tyrosine, N-[N-[N-(1-adamantylcarbonyl)glycyl]-L-leucyl]-, methyl ester, L-

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

Density: 1.2±0.1 g/cm3
Boiling Point: 808.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 121.5±3.0 kJ/mol
Flash Point: 442.5±34.3 °C
Index of Refraction: 1.568
Molar Refractivity: 141.2±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 4.18
ACD/LogD (pH 5.5): 3.28
ACD/BCF (pH 5.5): 182.21
ACD/KOC (pH 5.5): 1444.50
ACD/LogD (pH 7.4): 3.28
ACD/BCF (pH 7.4): 181.38
ACD/KOC (pH 7.4): 1437.89
Polar Surface Area: 134 Å2
Polarizability: 56.0±0.5 10-24cm3
Surface Tension: 52.6±3.0 dyne/cm
Molar Volume: 431.5±3.0 cm3

Click to predict properties on the Chemicalize site


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