ChemSpider 2D Image | N-Acetyl-O-[(6-bromo-5-hydroxy-1H-indol-3-yl)carbonyl]-D-tyrosine | C20H17BrN2O6

N-Acetyl-O-[(6-bromo-5-hydroxy-1H-indol-3-yl)carbonyl]-D-tyrosine

  • Molecular FormulaC20H17BrN2O6
  • Average mass461.263 Da
  • Monoisotopic mass460.026978 Da
  • ChemSpider ID44210908

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

D-Tyrosine, N-acetyl-O-[(6-bromo-5-hydroxy-1H-indol-3-yl)carbonyl]- [ACD/Index Name]
N-Acetyl-O-[(6-brom-5-hydroxy-1H-indol-3-yl)carbonyl]-D-tyrosin [German] [ACD/IUPAC Name]
N-Acetyl-O-[(6-bromo-5-hydroxy-1H-indol-3-yl)carbonyl]-D-tyrosine [ACD/IUPAC Name]
N-Acétyl-O-[(6-bromo-5-hydroxy-1H-indol-3-yl)carbonyl]-D-tyrosine [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 754.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 115.4±3.0 kJ/mol
Flash Point: 410.3±32.9 °C
Index of Refraction: 1.691
Molar Refractivity: 108.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.89
ACD/LogD (pH 5.5): 0.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.66
ACD/LogD (pH 7.4): -1.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 129 Å2
Polarizability: 43.0±0.5 10-24cm3
Surface Tension: 70.9±3.0 dyne/cm
Molar Volume: 283.2±3.0 cm3

Click to predict properties on the Chemicalize site


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