ChemSpider 2D Image | CSID:8616904 | C59H95N15O18S

  • Molecular FormulaC59H95N15O18S
  • Average mass1334.540 Da
  • Monoisotopic mass1333.670044 Da
  • ChemSpider ID8616904

  • defined stereocentres - 11 of 11 defined stereocentres

More details:

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

L-α-Asparagyl-L-valyl-D-prolyl-L-lysyl-L-seryl-L-α-asparagyl-L-glutaminyl-L-phenylalanyl-L-valylglycyl-L-leucyl-L-methioninamid [German] [ACD/IUPAC Name]
L-α-Aspartyl-L-valyl-D-prolyl-L-lysyl-L-séryl-L-α-aspartyl-L-glutaminyl-L-phénylalanyl-L-valylglycyl-L-leucyl-L-méthioninamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 1730.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 289.0±3.0 kJ/mol
Flash Point: 1000.2±34.3 °C
Index of Refraction: 1.571
Molar Refractivity: 335.9±0.3 cm3
#H bond acceptors: 33
#H bond donors: 21
#Freely Rotating Bonds: 43
#Rule of 5 Violations: 3
ACD/LogP: -0.19
ACD/LogD (pH 5.5): -4.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.69
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 570 Å2
Polarizability: 133.2±0.5 10-24cm3
Surface Tension: 62.8±3.0 dyne/cm
Molar Volume: 1022.6±3.0 cm3

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