ChemSpider 2D Image | 2,3,4,5-Tetrachloro-6-(2,4,5,7-tetraiodo-6-oxido-3-oxo-3H-xanthen-9-yl)benzoate | C20H2Cl4I4O5

2,3,4,5-Tetrachloro-6-(2,4,5,7-tetraiodo-6-oxido-3-oxo-3H-xanthen-9-yl)benzoate

  • Molecular FormulaC20H2Cl4I4O5
  • Average mass971.658 Da
  • Monoisotopic mass969.484558 Da
  • ChemSpider ID3081885

  • Charge - Charge

More details:

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

2,3,4,5-Tetrachlor-6-(2,4,5,7-tetraiod-6-oxido-3-oxo-3H-xanthen-9-yl)benzoat [German] [ACD/IUPAC Name]
2,3,4,5-Tétrachloro-6-(2,4,5,7-tétraiodo-3-oxo-6-oxydo-3H-xanthén-9-yl)benzoate [French] [ACD/IUPAC Name]
2,3,4,5-Tetrachloro-6-(2,4,5,7-tetraiodo-6-oxido-3-oxo-3H-xanthen-9-yl)benzoate [ACD/IUPAC Name]
Benzoic acid, 2,3,4,5-tetrachloro-6-(6-hydroxy-2,4,5,7-tetraiodo-3-oxo-3H-xanthen-9-yl)-, ion(2-) [ACD/Index Name]
11121-48-5 [RN]
rose bengal anion
rose bengal dianion
rose bengal(2-)

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

1445395 [DBID]
  • Miscellaneous

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

Density:
Boiling Point: 757.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 115.8±3.0 kJ/mol
Flash Point: 412.1±32.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: 9.58
ACD/LogD (pH 5.5): 5.79
ACD/BCF (pH 5.5): 2128.50
ACD/KOC (pH 5.5): 851.06
ACD/LogD (pH 7.4): 5.16
ACD/BCF (pH 7.4): 502.10
ACD/KOC (pH 7.4): 200.76
Polar Surface Area: 89 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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