ChemSpider 2D Image | 3-Hydroxy-7-[3-methyl-5-oxo-4-(phenyldiazenyl)-4,5-dihydro-1H-pyrazol-1-yl]-1-naphthalenesulfonic acid | C20H16N4O5S

3-Hydroxy-7-[3-methyl-5-oxo-4-(phenyldiazenyl)-4,5-dihydro-1H-pyrazol-1-yl]-1-naphthalenesulfonic acid

  • Molecular FormulaC20H16N4O5S
  • Average mass424.430 Da
  • Monoisotopic mass424.084137 Da
  • ChemSpider ID21162716

More details:

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

1-Naphthalenesulfonic acid, 7-[4,5-dihydro-3-methyl-5-oxo-4-(2-phenyldiazenyl)-1H-pyrazol-1-yl]-3-hydroxy- [ACD/Index Name]
269-378-4 [EINECS]
3-Hydroxy-7-[3-methyl-5-oxo-4-(phenyldiazenyl)-4,5-dihydro-1H-pyrazol-1-yl]-1-naphthalenesulfonic acid [ACD/IUPAC Name]
3-Hydroxy-7-[3-methyl-5-oxo-4-(phenyldiazenyl)-4,5-dihydro-1H-pyrazol-1-yl]-1-naphthalinsulfonsäure [German] [ACD/IUPAC Name]
3-Hydroxy-7-[3-methyl-5-oxo-4-(phenyldiazenyl)-4,5-dihydro-1H-pyrazol-1-yl]naphthalene-1-sulfonic acid
Acide 3-hydroxy-7-[3-méthyl-5-oxo-4-(phényldiazényl)-4,5-dihydro-1H-pyrazol-1-yl]-1-naphtalènesulfonique [French] [ACD/IUPAC Name]
68227-67-8 [RN]
7-[4,5-dihydro-3-methyl-5-oxo-4-(phenylazo)-1H-pyrazol-1-yl]-3-hydroxynaphthalene-1-sulphonic acid

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: 1.725
Molar Refractivity: 109.8±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.05
ACD/LogD (pH 5.5): -2.79
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 140 Å2
Polarizability: 43.5±0.5 10-24cm3
Surface Tension: 67.1±7.0 dyne/cm
Molar Volume: 276.5±7.0 cm3

Click to predict properties on the Chemicalize site


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