ChemSpider 2D Image | O-(4-Hydroxyphenyl)-alpha,beta,beta-triiodo-L-tyrosine | C15H12I3NO4

O-(4-Hydroxyphenyl)-α,β,β-triiodo-L-tyrosine

  • Molecular FormulaC15H12I3NO4
  • Average mass650.974 Da
  • Monoisotopic mass650.790039 Da
  • ChemSpider ID67026818

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

L-Tyrosine, O-(4-hydroxyphenyl)-α,β,β-triiodo- [ACD/Index Name]
O-(4-Hydroxyphenyl)-α,β,β-triiod-L-tyrosin [German] [ACD/IUPAC Name]
O-(4-Hydroxyphenyl)-α,β,β-triiodo-L-tyrosine [ACD/IUPAC Name]
O-(4-Hydroxyphényl)-α,β,β-triiodo-L-tyrosine [French] [ACD/IUPAC Name]
Triiodo-L-thyronine

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

Density: 2.5±0.1 g/cm3
Boiling Point: 543.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.5±3.0 kJ/mol
Flash Point: 282.4±30.1 °C
Index of Refraction: 1.797
Molar Refractivity: 112.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 8.30
ACD/LogD (pH 5.5): 1.97
ACD/BCF (pH 5.5): 2.69
ACD/KOC (pH 5.5): 7.15
ACD/LogD (pH 7.4): 1.73
ACD/BCF (pH 7.4): 1.52
ACD/KOC (pH 7.4): 4.05
Polar Surface Area: 93 Å2
Polarizability: 44.5±0.5 10-24cm3
Surface Tension: 80.7±3.0 dyne/cm
Molar Volume: 263.5±3.0 cm3

Click to predict properties on the Chemicalize site


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