ChemSpider 2D Image | 4-Hydroxy-5-[(E)-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)diazenyl]-1,3-benzenedisulfonic acid | C16H14N4O8S2

4-Hydroxy-5-[(E)-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)diazenyl]-1,3-benzenedisulfonic acid

  • Molecular FormulaC16H14N4O8S2
  • Average mass454.434 Da
  • Monoisotopic mass454.025299 Da
  • ChemSpider ID95642618

  • Double-bond stereo - Double-bond stereo

More details:

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

1,3-Benzenedisulfonic acid, 4-hydroxy-5-[(E)-2-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)diazenyl]- [ACD/Index Name]
4-Hydroxy-5-[(E)-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)diazenyl]-1,3-benzenedisulfonic acid [ACD/IUPAC Name]
4-Hydroxy-5-[(E)-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)diazenyl]-1,3-benzoldisulfonsäure [German] [ACD/IUPAC Name]
Acide 4-hydroxy-5-[(E)-(5-hydroxy-3-méthyl-1-phényl-1H-pyrazol-4-yl)diazényl]-1,3-benzènedisulfonique [French] [ACD/IUPAC Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.743
Molar Refractivity: 104.5±0.5 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 1.43
ACD/LogD (pH 5.5): -4.47
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 209 Å2
Polarizability: 41.4±0.5 10-24cm3
Surface Tension: 82.6±7.0 dyne/cm
Molar Volume: 258.2±7.0 cm3

Click to predict properties on the Chemicalize site


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