ChemSpider 2D Image | 3-Iodo-O-[3-iodo-4-(sulfooxy)phenyl]tyrosine | C15H13I2NO7S

3-Iodo-O-[3-iodo-4-(sulfooxy)phenyl]tyrosine

  • Molecular FormulaC15H13I2NO7S
  • Average mass605.140 Da
  • Monoisotopic mass604.850220 Da
  • ChemSpider ID28477177

More details:

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

3-Iod-O-[3-iod-4-(sulfooxy)phenyl]tyrosin [German] [ACD/IUPAC Name]
3-Iodo-O-[3-iodo-4-(sulfooxy)phenyl]tyrosine [ACD/IUPAC Name]
3-Iodo-O-[3-iodo-4-(sulfooxy)phényl]tyrosine [French] [ACD/IUPAC Name]
Tyrosine, 3-iodo-O-[3-iodo-4-(sulfooxy)phenyl]- [ACD/Index Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL2074890/

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: 4.40
ACD/LogD (pH 5.5): -1.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.01
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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