ChemSpider 2D Image | 2-[(3,5-Diiodo-4-oxo-2,5-cyclohexadien-1-ylidene)(4-hydroxy-3,5-diiodophenyl)methyl]benzenesulfonic acid | C19H10I4O5S

2-[(3,5-Diiodo-4-oxo-2,5-cyclohexadien-1-ylidene)(4-hydroxy-3,5-diiodophenyl)methyl]benzenesulfonic acid

  • Molecular FormulaC19H10I4O5S
  • Average mass857.963 Da
  • Monoisotopic mass857.642761 Da
  • ChemSpider ID3594526

More details:

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

2-[(3,5-Diiod-4-oxo-2,5-cyclohexadien-1-yliden)(4-hydroxy-3,5-diiodphenyl)methyl]benzolsulfonsäure [German] [ACD/IUPAC Name]
2-[(3,5-Diiodo-4-oxo-2,5-cyclohexadien-1-ylidene)(4-hydroxy-3,5-diiodophenyl)methyl]benzenesulfonic acid [ACD/IUPAC Name]
Acide 2-[(3,5-diiodo-4-oxo-2,5-cyclohexadién-1-ylidène)(4-hydroxy-3,5-diiodophényl)méthyl]benzènesulfonique [French] [ACD/IUPAC Name]
Benzenesulfonic acid, 2-[(3,5-diiodo-4-oxo-2,5-cyclohexadien-1-ylidene)(4-hydroxy-3,5-diiodophenyl)methyl]- [ACD/Index Name]
2-[(3,5-diiodo-4-oxocyclohexa-2,5-dienylidene)(4-hydroxy-3,5-diiodophenyl)methyl]benzenesulfonic acid
224-621-3 [EINECS]
3',3,5',5-Tetraiodophenolsulfophthalein
3′,3′′,5′,5′′-Tetraiodophenolsulfonephthalein
4430-24-4 [RN]
Iodophenol Blue

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

230979_ALDRICH [DBID]
T-2000 [DBID]

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

Density: 2.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.886
Molar Refractivity: 144.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: 5.51
ACD/LogD (pH 5.5): 0.90
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.78
ACD/LogD (pH 7.4): 0.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 100 Å2
Polarizability: 57.2±0.5 10-24cm3
Surface Tension: 99.5±5.0 dyne/cm
Molar Volume: 313.8±5.0 cm3

Click to predict properties on the Chemicalize site


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