ChemSpider 2D Image | Benzyl L-cysteinyl-L-isoleucyl-L-phenylalanyl-L-methioninate | C30H42N4O5S2

Benzyl L-cysteinyl-L-isoleucyl-L-phenylalanyl-L-methioninate

  • Molecular FormulaC30H42N4O5S2
  • Average mass602.808 Da
  • Monoisotopic mass602.259644 Da
  • ChemSpider ID9933024

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

Benzyl L-cysteinyl-L-isoleucyl-L-phenylalanyl-L-methioninate [ACD/IUPAC Name]
Benzyl-L-cysteinyl-L-isoleucyl-L-phenylalanyl-L-methioninat [German] [ACD/IUPAC Name]
L-Cystéinyl-L-isoleucyl-L-phénylalanyl-L-méthioninate de benzyle [French] [ACD/IUPAC Name]
L-Methionine, L-cysteinyl-L-isoleucyl-L-phenylalanyl-, phenylmethyl ester [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 864.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 125.6±3.0 kJ/mol
Flash Point: 476.4±34.3 °C
Index of Refraction: 1.577
Molar Refractivity: 166.3±0.3 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 3
ACD/LogP: 5.68
ACD/LogD (pH 5.5): 2.11
ACD/BCF (pH 5.5): 15.02
ACD/KOC (pH 5.5): 140.70
ACD/LogD (pH 7.4): 2.90
ACD/BCF (pH 7.4): 93.00
ACD/KOC (pH 7.4): 871.40
Polar Surface Area: 204 Å2
Polarizability: 65.9±0.5 10-24cm3
Surface Tension: 50.0±3.0 dyne/cm
Molar Volume: 501.9±3.0 cm3

Click to predict properties on the Chemicalize site


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