ChemSpider 2D Image | O-(4-Hydroxy-3,5-diiodophenyl)-L-tyrosine | C15H13I2NO4

O-(4-Hydroxy-3,5-diiodophenyl)-L-tyrosine

  • Molecular FormulaC15H13I2NO4
  • Average mass525.077 Da
  • Monoisotopic mass524.893372 Da
  • ChemSpider ID4954250

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

224-071-4 [EINECS]
262-198-7 [EINECS]
4192-14-7 [RN]
60363-25-9 [RN]
DL-Tyrosine, O-(4-hydroxy-3,5-diiodophenyl)-
L-Tyrosine, O-(4-hydroxy-3,5-diiodophenyl)- [ACD/Index Name]
O-(4-Hydroxy-3,5-diiodophenyl)-L-tyrosine [ACD/IUPAC Name]
O-(4-Hydroxy-3,5-diiodophényl)-L-tyrosine [French] [ACD/IUPAC Name]
O-(4-Hydroxy-3,5-diiodphenyl)-L-tyrosin [German] [ACD/IUPAC Name]
"3`,5`-DIIODOTHYRONINE"
More...

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

    Density: 2.1±0.1 g/cm3
    Boiling Point: 497.0±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 80.6±3.0 kJ/mol
    Flash Point: 254.4±28.7 °C
    Index of Refraction: 1.726
    Molar Refractivity: 99.6±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 4
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 1
    ACD/LogP: 4.39
    ACD/LogD (pH 5.5): 1.14
    ACD/BCF (pH 5.5): 1.08
    ACD/KOC (pH 5.5): 7.12
    ACD/LogD (pH 7.4): 0.79
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.23
    Polar Surface Area: 93 Å2
    Polarizability: 39.5±0.5 10-24cm3
    Surface Tension: 71.7±3.0 dyne/cm
    Molar Volume: 250.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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