ChemSpider 2D Image | bathocuproine disulfonic acid | C26H20N2O6S2

bathocuproine disulfonic acid

  • Molecular FormulaC26H20N2O6S2
  • Average mass520.577 Da
  • Monoisotopic mass520.076294 Da
  • ChemSpider ID148907

More details:

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

4,4'-(2,9-Dimethyl-1,10-phenanthrolin-4,7-diyl)dibenzolsulfonsäure [German] [ACD/IUPAC Name]
4,4'-(2,9-Dimethyl-1,10-phenanthroline-4,7-diyl)dibenzenesulfonic acid [ACD/IUPAC Name]
Acide 4,4'-(2,9-diméthyl-1,10-phénanthroline-4,7-diyl)dibenzènesulfonique [French] [ACD/IUPAC Name]
bathocuproine disulfonic acid
Benzenesulfonic acid, 4,4'-(2,9-dimethyl-1,10-phenanthroline-4,7-diyl)bis- [ACD/Index Name]
31037-51-1 [RN]
4-[2,9-DIMETHYL-7-(4-SULFOPHENYL)-1,10-PHENANTHROLIN-4-YL]BENZENE-1-SULFONIC ACID
73348-75-1 [RN]
bathocuproine disulfonate
bathocuproine sulfonate
More...

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

CHEBI:63934 [DBID]
  • Miscellaneous

    • Chemical Class:

      A phenanthroline that consists of 1,10-phenanthroline bearing two methyl groups at position 2 and 9 as well as two 4-sulfophenyl groups at positions 4 and 7. ChEBI CHEBI:63934

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.703
Molar Refractivity: 136.8±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 2.75
ACD/LogD (pH 5.5): -2.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.60
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 151 Å2
Polarizability: 54.2±0.5 10-24cm3
Surface Tension: 69.0±3.0 dyne/cm
Molar Volume: 352.8±3.0 cm3

Click to predict properties on the Chemicalize site


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