ChemSpider 2D Image | Methyl N-[(benzyloxy)carbonyl]threonylalanylleucylleucylglycinate | C30H47N5O9

Methyl N-[(benzyloxy)carbonyl]threonylalanylleucylleucylglycinate

  • Molecular FormulaC30H47N5O9
  • Average mass621.722 Da
  • Monoisotopic mass621.337402 Da
  • ChemSpider ID497872

More details:

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

Glycine, N-[(phenylmethoxy)carbonyl]threonylalanylleucylleucyl-, methyl ester [ACD/Index Name]
Methyl N-[(benzyloxy)carbonyl]threonylalanylleucylleucylglycinate [ACD/IUPAC Name]
MethylN-[(benzyloxy)carbonyl]threonylalanylleucylleucylglycinat [German] [ACD/IUPAC Name]
N-[(Benzyloxy)carbonyl]thréonylalanylleucylleucylglycinate de méthyle [French] [ACD/IUPAC Name]
Glycine, N-[N-[N-[N-(N-carboxy-L-threonyl)-L-alanyl]-L-leucyl]-L-leucyl]-, N-benzyl methyl ester
Methyl 5-(1-hydroxyethyl)-11,14-diisobutyl-8-methyl-3,6,9,12,15-pentaoxo-1-phenyl-2-oxa-4,7,10,13,16-pentaazaoctadecan-18-oate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 907.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 138.3±3.0 kJ/mol
Flash Point: 502.8±34.3 °C
Index of Refraction: 1.524
Molar Refractivity: 160.6±0.3 cm3
#H bond acceptors: 14
#H bond donors: 6
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 3
ACD/LogP: 3.39
ACD/LogD (pH 5.5): 2.25
ACD/BCF (pH 5.5): 30.00
ACD/KOC (pH 5.5): 396.91
ACD/LogD (pH 7.4): 2.25
ACD/BCF (pH 7.4): 30.00
ACD/KOC (pH 7.4): 396.80
Polar Surface Area: 201 Å2
Polarizability: 63.7±0.5 10-24cm3
Surface Tension: 46.0±3.0 dyne/cm
Molar Volume: 525.1±3.0 cm3

Click to predict properties on the Chemicalize site


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