ChemSpider 2D Image | (2S)-2-Amino-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]propanoate | C15H10I4NO4


  • Molecular FormulaC15H10I4NO4
  • Average mass775.863 Da
  • Monoisotopic mass775.679382 Da
  • ChemSpider ID21230501
  • Charge - Charge

More details:

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

(2S)-2-Amino-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]propanoate [ACD/IUPAC Name]
(2S)-2-Amino-3-[4-(4-hydroxy-3,5-diiodophénoxy)-3,5-diiodophényl]propanoate [French] [ACD/IUPAC Name]
(2S)-2-Amino-3-[4-(4-hydroxy-3,5-diiodphenoxy)-3,5-diiodphenyl]propanoat [German] [ACD/IUPAC Name]
L-Tyrosine, O-(4-hydroxy-3,5-diiodophenyl)-3,5-diiodo-, ion(1-) [ACD/Index Name]
levothyroxine anion
L-thyroxine anion
  • Miscellaneous
    • Chemical Class:

      The alpha-amino-acid anion resulting from the removal of the proton from the carboxylic acid group of L-thyroxine. ChEBI CHEBI:60302

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

Boiling Point: 576.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.8±3.0 kJ/mol
Flash Point: 302.3±30.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 5.93
ACD/LogD (pH 5.5): 2.29
ACD/BCF (pH 5.5): 8.02
ACD/KOC (pH 5.5): 29.83
ACD/LogD (pH 7.4): 1.76
ACD/BCF (pH 7.4): 2.38
ACD/KOC (pH 7.4): 8.84
Polar Surface Area: 96 Å2
Surface Tension:
Molar Volume:

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