[(3E)-6-Oxo-3-{[4-(2-Pyridinylsulfamoyl)Phenyl]Hydrazono}-1,4-Cyclohexadien-1-Yl]Acetic Acid

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Properties Simple | Detailed

Formula C19H16N4O5S
IUPAC Name 2-[(3e)-6-oxo-3-[[4-(2-pyridylsulfamoyl)phenyl]hydrazono]cyclohexa-1,4-dien-1-yl]acetic acid
Molecular Mass 412.419 g·mol−1
Heat of Formation -332.8 ± 16.7 kJ·mol−1
Dipole Moment 4.35 ± 1.08 D
Volume 449.23 Å 3
Surface Area 400.83 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy -1.96 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[(3e)-6-keto-3-[[4-(2-pyridylsulfamoyl)phenyl]hydrazono]-1-cyclohexa-1,4-dienyl]acetic acid
  • 2-[(3e)-6-oxo-3-[[4-(2-pyridylsulfamoyl)phenyl]hydrazono]-1-cyclohexa-1,4-dienyl]acetic acid
  • 2-[(3e)-6-oxo-3-[[4-(pyridin-2-ylsulfamoyl)phenyl]hydrazinylidene]-1-cyclohexa-1,4-dienyl]acetic acid
  • 2-[(3e)-6-oxo-3-[[4-(pyridin-2-ylsulfamoyl)phenyl]hydrazinylidene]-1-cyclohexa-1,4-dienyl]ethanoic acid
  • 2-hydroxy-5(4-(((2-pyridiny)amino)sulphonyl)phenylazo)-benzeneacetic acid
  • benzeneacetic acid, 2-hydroxy-5-((4-((2-pyridinylamino)sulfonyl)phenyl)azo)-
  • homosulphasalazine
  • ph ch 44a
CAS Number(s)
  • 73536-01-3
InChIKey OCHFQLZWGLEZBT-PXLXIMEGSA-N
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