ChemSpider 2D Image | O-[3,5-Diiodo-4-(sulfooxy)phenyl]-D-tyrosine | C15H13I2NO7S

O-[3,5-Diiodo-4-(sulfooxy)phenyl]-D-tyrosine

  • Molecular FormulaC15H13I2NO7S
  • Average mass605.140 Da
  • Monoisotopic mass604.850220 Da
  • ChemSpider ID30778526

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

D-Tyrosine, O-[3,5-diiodo-4-(sulfooxy)phenyl]- [ACD/Index Name]
O-[3,5-Diiod-4-(sulfooxy)phenyl]-D-tyrosin [German] [ACD/IUPAC Name]
O-[3,5-Diiodo-4-(sulfooxy)phenyl]-D-tyrosine [ACD/IUPAC Name]
O-[3,5-Diiodo-4-(sulfooxy)phényl]-D-tyrosine [French] [ACD/IUPAC Name]
(2R)-2-amino-3-{4-[3,5-diiodo-4-(sulfooxy)phenoxy]phenyl}propanoic acid
3',5'-Diiodo-L-thyronine 4'-O-sulfate

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

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

Density: 2.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.723
Molar Refractivity: 110.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 4.07
ACD/LogD (pH 5.5): -2.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 145 Å2
Polarizability: 43.7±0.5 10-24cm3
Surface Tension: 79.6±3.0 dyne/cm
Molar Volume: 278.2±3.0 cm3

Click to predict properties on the Chemicalize site


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