ChemSpider 2D Image | Methyl 1-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-prolyl-2-methylalanylleucyl-2-methylalanyl-D-valinate | C30H53N5O8

Methyl 1-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-prolyl-2-methylalanylleucyl-2-methylalanyl-D-valinate

  • Molecular FormulaC30H53N5O8
  • Average mass611.771 Da
  • Monoisotopic mass611.389404 Da
  • ChemSpider ID30660073

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

1-{[(2-Méthyl-2-propanyl)oxy]carbonyl}-L-prolyl-2-méthylalanylleucyl-2-méthylalanyl-D-valinate de méthyle [French] [ACD/IUPAC Name]
D-Valine, 1-[(1,1-dimethylethoxy)carbonyl]-L-prolyl-2-methylalanylleucyl-2-methylalanyl-, methyl ester [ACD/Index Name]
Methyl 1-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-prolyl-2-methylalanylleucyl-2-methylalanyl-D-valinate [ACD/IUPAC Name]
Methyl-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-prolyl-2-methylalanylleucyl-2-methylalanyl-D-valinat [German] [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: 815.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 118.6±3.0 kJ/mol
Flash Point: 447.2±34.3 °C
Index of Refraction: 1.501
Molar Refractivity: 160.1±0.3 cm3
#H bond acceptors: 13
#H bond donors: 4
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 2.90
ACD/LogD (pH 5.5): 2.38
ACD/BCF (pH 5.5): 37.96
ACD/KOC (pH 5.5): 469.70
ACD/LogD (pH 7.4): 2.38
ACD/BCF (pH 7.4): 37.96
ACD/KOC (pH 7.4): 469.70
Polar Surface Area: 172 Å2
Polarizability: 63.5±0.5 10-24cm3
Surface Tension: 43.0±3.0 dyne/cm
Molar Volume: 543.5±3.0 cm3

Click to predict properties on the Chemicalize site


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