ChemSpider 2D Image | 2,5-Dichlor-4-{3-methyl-5-oxo-4-[(E)-(4-sulfonatophenyl)diazenyl]-4,5-dihydro-1H-pyrazol-1-yl}benzolsulfonat | C16H10Cl2N4O7S2

2,5-Dichlor-4-{3-methyl-5-oxo-4-[(E)-(4-sulfonatophenyl)diazenyl]-4,5-dihydro-1H-pyrazol-1-yl}benzolsulfonat

  • Molecular FormulaC16H10Cl2N4O7S2
  • Average mass505.310 Da
  • Monoisotopic mass503.937897 Da
  • ChemSpider ID3490830
  • Charge - Charge

    Double-bond stereo - Double-bond stereo


More details:






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

2,5-Dichlor-4-{3-methyl-5-oxo-4-[(E)-(4-sulfonatophenyl)diazenyl]-4,5-dihydro-1H-pyrazol-1-yl}benzolsulfonat
2,5-Dichlor-4-{3-methyl-5-oxo-4-[(E)-(4-sulfonatophenyl)diazenyl]-4,5-dihydro-1H-pyrazol-1-yl}benzolsulfonat [German] [ACD/IUPAC Name]
2,5-Dichloro-4-{3-methyl-5-oxo-4-[(E)-(4-sulfonatophenyl)diazenyl]-4,5-dihydro-1H-pyrazol-1-yl}benzenesulfonate [ACD/IUPAC Name]
2,5-Dichloro-4-{3-méthyl-5-oxo-4-[(E)-(4-sulfonatophényl)diazényl]-4,5-dihydro-1H-pyrazol-1-yl}benzènesulfonate [French] [ACD/IUPAC Name]
2,5-Dichloro-4-{3-méthyl-5-oxo-4-[(E)-(4-sulfonatophényl)diazènyl]-4,5-dihydro-1H-pyrazol-1-yl}benzènesulfonate
Benzenesulfonic acid, 2,5-dichloro-4-[4,5-dihydro-3-methyl-5-oxo-4-[(E)-2-(4-sulfophenyl)diazenyl]-1H-pyrazol-1-yl]-, ion(2-) [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 0.55
ACD/LogD (pH 5.5): -4.36
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 189 Å2
Polarizability:
Surface Tension:
Molar Volume:

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