ChemSpider 2D Image | 2-[(3,5-Dibromo-4-hydroxyphenyl)(3,5-dibromo-4-oxo-2,5-cyclohexadien-1-ylidene)methyl]benzenesulfonic acid | C19H10Br4O5S

2-[(3,5-Dibromo-4-hydroxyphenyl)(3,5-dibromo-4-oxo-2,5-cyclohexadien-1-ylidene)methyl]benzenesulfonic acid

  • Molecular FormulaC19H10Br4O5S
  • Average mass669.961 Da
  • Monoisotopic mass665.698242 Da
  • ChemSpider ID101178

More details:

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

2-[(3,5-Dibrom-4-hydroxyphenyl)(3,5-dibrom-4-oxo-2,5-cyclohexadien-1-yliden)methyl]benzolsulfonsäure [German] [ACD/IUPAC Name]
2-[(3,5-Dibromo-4-hydroxyphenyl)(3,5-dibromo-4-oxo-2,5-cyclohexadien-1-ylidene)methyl]benzenesulfonic acid [ACD/IUPAC Name]
Acide 2-[(3,5-dibromo-4-hydroxyphényl)(3,5-dibromo-4-oxo-2,5-cyclohexadién-1-ylidène)méthyl]benzènesulfonique [French] [ACD/IUPAC Name]
Benzenesulfonic acid, 2-[(3,5-dibromo-4-hydroxyphenyl)(3,5-dibromo-4-oxo-2,5-cyclohexadien-1-ylidene)methyl]- [ACD/Index Name]
2-[(3,5-dibromo-4-hydroxyphenyl)(3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]benzenesulfonic acid
2-[(3,5-Dibromo-4-hydroxy-phenyl)-(3,5-dibromo-4-oxo-cyclohexa-2,5-dienylidene)-methyl]-benzenesulfonic acid

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

Density: 2.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.754
Molar Refractivity: 123.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 4.70
ACD/LogD (pH 5.5): 0.45
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 100 Å2
Polarizability: 49.0±0.5 10-24cm3
Surface Tension: 78.6±3.0 dyne/cm
Molar Volume: 302.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement