ChemSpider 2D Image | 2-Hydroxy-5-[4,5,6,7-tetrabromo-1-(4-hydroxy-3-sulfophenyl)-3-oxo-1,3-dihydro-2-benzofuran-1-yl]benzenesulfonate | C20H9Br4O10S2

2-Hydroxy-5-[4,5,6,7-tetrabromo-1-(4-hydroxy-3-sulfophenyl)-3-oxo-1,3-dihydro-2-benzofuran-1-yl]benzenesulfonate

  • Molecular FormulaC20H9Br4O10S2
  • Average mass793.026 Da
  • Monoisotopic mass788.637573 Da
  • ChemSpider ID3403469

  • Charge - Charge

More details:

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

2-Hydroxy-5-[4,5,6,7-tetrabrom-1-(4-hydroxy-3-sulfophenyl)-3-oxo-1,3-dihydro-2-benzofuran-1-yl]benzolsulfonat [German] [ACD/IUPAC Name]
2-Hydroxy-5-[4,5,6,7-tetrabromo-1-(4-hydroxy-3-sulfophenyl)-3-oxo-1,3-dihydro-2-benzofuran-1-yl]benzenesulfonate [ACD/IUPAC Name]
2-Hydroxy-5-[4,5,6,7-tétrabromo-1-(4-hydroxy-3-sulfophényl)-3-oxo-1,3-dihydro-2-benzofuran-1-yl]benzènesulfonate [French] [ACD/IUPAC Name]
Benzenesulfonic acid, 3,3'-(4,5,6,7-tetrabromo-1,3-dihydro-3-oxo-1-isobenzofuranylidene)bis[6-hydroxy-, 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: 10
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 3.35
ACD/LogD (pH 5.5): -1.73
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 195 Å2
Polarizability:
Surface Tension:
Molar Volume:

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