ChemSpider 2D Image | Tyrosyl-N-{[(3-methylbutyl)amino]acetyl}alaninamide | C19H30N4O4

Tyrosyl-N-{[(3-methylbutyl)amino]acetyl}alaninamide

  • Molecular FormulaC19H30N4O4
  • Average mass378.466 Da
  • Monoisotopic mass378.226715 Da
  • ChemSpider ID21106389
  • defined stereocentres - 1 of 2 defined stereocentres


More details:






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

Alaninamide, tyrosyl-N-[2-[(3-methylbutyl)amino]acetyl]- [ACD/Index Name]
Tyrosyl-N-{[(3-methylbutyl)amino]acetyl}alaninamid [German] [ACD/IUPAC Name]
Tyrosyl-N-{[(3-methylbutyl)amino]acetyl}alaninamide [ACD/IUPAC Name]
Tyrosyl-N-{2-[(3-méthylbutyl)amino]acétyl}alaninamide [French] [ACD/IUPAC Name]
90815-77-3 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 637.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.6±3.0 kJ/mol
Flash Point: 339.3±31.5 °C
Index of Refraction: 1.546
Molar Refractivity: 102.9±0.3 cm3
#H bond acceptors: 8
#H bond donors: 6
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 0.00
ACD/LogD (pH 5.5): -3.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.82
Polar Surface Area: 134 Å2
Polarizability: 40.8±0.5 10-24cm3
Surface Tension: 48.4±3.0 dyne/cm
Molar Volume: 324.9±3.0 cm3

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