ChemSpider 2D Image | 2-Ammonio-3-{3-iodo-4-[3-iodo-4-(sulfonatooxy)phenoxy]phenyl}propanoate | C15H12I2NO7S

2-Ammonio-3-{3-iodo-4-[3-iodo-4-(sulfonatooxy)phenoxy]phenyl}propanoate

  • Molecular FormulaC15H12I2NO7S
  • Average mass604.133 Da
  • Monoisotopic mass603.842896 Da
  • ChemSpider ID21233580

  • Charge - Charge

More details:

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

2-Ammonio-3-{3-iod-4-[3-iod-4-(sulfonatooxy)phenoxy]phenyl}propanoat [German] [ACD/IUPAC Name]
2-Ammonio-3-{3-iodo-4-[3-iodo-4-(sulfonatooxy)phenoxy]phenyl}propanoate [ACD/IUPAC Name]
2-Ammonio-3-{3-iodo-4-[3-iodo-4-(sulfonatooxy)phénoxy]phényl}propanoate [French] [ACD/IUPAC Name]
Tyrosine, 3-iodo-O-[3-iodo-4-(sulfooxy)phenyl]-, inner salt, ion(1-) [ACD/Index Name]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#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: 152 Å2
Polarizability:
Surface Tension:
Molar Volume:

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