ChemSpider 2D Image | 3-[4-(4-Hydroxy-3-iodophenoxy)-3,5-diiodophenyl]-2-oxopropanoate | C15H8I3O5

3-[4-(4-Hydroxy-3-iodophenoxy)-3,5-diiodophenyl]-2-oxopropanoate

  • Molecular FormulaC15H8I3O5
  • Average mass648.935 Da
  • Monoisotopic mass648.751099 Da
  • ChemSpider ID20015883

  • Charge - Charge

More details:

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

3-[4-(4-Hydroxy-3-iodophenoxy)-3,5-diiodophenyl]-2-oxopropanoate [ACD/IUPAC Name]
3-[4-(4-Hydroxy-3-iodophénoxy)-3,5-diiodophényl]-2-oxopropanoate [French] [ACD/IUPAC Name]
3-[4-(4-Hydroxy-3-iodphenoxy)-3,5-diiodphenyl]-2-oxopropanoat [German] [ACD/IUPAC Name]
Benzenepropanoic acid, 4-(4-hydroxy-3-iodophenoxy)-3,5-diiodo-α-oxo-, ion(1-) [ACD/Index Name]
3,5,3'-Triiodothyropyruvate

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

Density:
Boiling Point: 557.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.4±3.0 kJ/mol
Flash Point: 291.1±30.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 4.51
ACD/LogD (pH 5.5): 1.50
ACD/BCF (pH 5.5): 1.48
ACD/KOC (pH 5.5): 6.13
ACD/LogD (pH 7.4): 0.81
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.24
Polar Surface Area: 87 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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