ChemSpider 2D Image | Threonylasparaginylprolylprolylalanylprolylthreonylcysteinylthreonylthreoninamide | C41H68N12O15S

Threonylasparaginylprolylprolylalanylprolylthreonylcysteinylthreonylthreoninamide

  • Molecular FormulaC41H68N12O15S
  • Average mass1001.115 Da
  • Monoisotopic mass1000.464783 Da
  • ChemSpider ID78445699

  • defined stereocentres - 4 of 14 defined stereocentres

More details:

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

Threoninamide, threonylasparaginylprolylprolylalanylprolylthreonylcysteinylthreonyl- [ACD/Index Name]
Threonylasparaginylprolylprolylalanylprolylthreonylcysteinylthreonylthreoninamid [German] [ACD/IUPAC Name]
Threonylasparaginylprolylprolylalanylprolylthreonylcysteinylthreonylthreoninamide [ACD/IUPAC Name]
Thréonylasparaginylprolylprolylalanylprolylthréonylcystéinylthréonylthréoninamide [French] [ACD/IUPAC Name]
POH 3

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

Density: 1.4±0.1 g/cm3
Boiling Point: 1540.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 267.9±6.0 kJ/mol
Flash Point: 885.7±34.3 °C
Index of Refraction: 1.599
Molar Refractivity: 242.0±0.3 cm3
#H bond acceptors: 27
#H bond donors: 16
#Freely Rotating Bonds: 23
#Rule of 5 Violations: 3
ACD/LogP: -3.97
ACD/LogD (pH 5.5): -5.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.88
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 467 Å2
Polarizability: 95.9±0.5 10-24cm3
Surface Tension: 73.2±3.0 dyne/cm
Molar Volume: 708.1±3.0 cm3

Click to predict properties on the Chemicalize site


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