ChemSpider 2D Image | 8IGM4I6Q6G | C15H12I3NO4

8IGM4I6Q6G

  • Molecular FormulaC15H12I3NO4
  • Average mass650.974 Da
  • Monoisotopic mass650.790039 Da
  • ChemSpider ID20738

More details:






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

3,3',5'-TRIIODOTHYRONINE, D-
3,3',5'-TRIIODOTHYRONINE, L-
3',5',3-Triiodothyronine
70-39-3 [RN]
8IGM4I6Q6G
DL-3,3',5'-triiodothyronine
O-(4-Hydroxy-3,5-diiodophenyl)-3-iodotyrosine [ACD/IUPAC Name]
O-(4-Hydroxy-3,5-diiodophényl)-3-iodotyrosine [French] [ACD/IUPAC Name]
O-(4-Hydroxy-3,5-diiodphenyl)-3-iodtyrosin [German] [ACD/IUPAC Name]
Tyrosine, O-(4-hydroxy-3,5-diiodophenyl)-3-iodo- [ACD/Index Name]
More...

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

CHEBI:28774 [DBID]
OSG881195S [DBID]
T0281_SIGMA [DBID]

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

Density: 2.4±0.1 g/cm3
Boiling Point: 534.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.3±3.0 kJ/mol
Flash Point: 277.1±30.1 °C
Index of Refraction: 1.763
Molar Refractivity: 112.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 5.39
ACD/LogD (pH 5.5): 1.72
ACD/BCF (pH 5.5): 2.96
ACD/KOC (pH 5.5): 14.66
ACD/LogD (pH 7.4): 1.30
ACD/BCF (pH 7.4): 1.13
ACD/KOC (pH 7.4): 5.58
Polar Surface Area: 93 Å2
Polarizability: 44.6±0.5 10-24cm3
Surface Tension: 75.9±3.0 dyne/cm
Molar Volume: 272.7±3.0 cm3

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