(6Z)-6-({4-[(E)-2-{4-[(2E)-2-(2-Carboxy-6-Hydroxy-4-Oxo-2,5-Cyclohexadien-1-Ylidene)Hydrazino]-2-Sulfophenyl}Vinyl]-3-Sulfophenyl}Hydrazono)-5-Hydroxy-3-Oxo-1,4-Cyclohexadiene-1-Carboxylic Acid

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Properties Simple | Detailed

Formula C28H28N4O14S2
IUPAC Name (6e)-6-[[4-[(e)-2-[4-[(2z)-2-(2-carboxy-6-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)hydrazinyl]-2-sulfophenyl]ethenyl]-3-sulfophenyl]hydrazinylidene]-5-hydroxy-3-oxocyclohexa-1,4-diene-1-carboxylic acid
Molecular Mass 708.670 g·mol−1
Heat of Formation -1623.1 ± 16.7 kJ·mol−1
Dipole Moment 2.63 ± 1.08 D
Volume 712.11 Å 3
Surface Area 606.5 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy -1.96 ± eV
Point Group Symmetry C1
Synonyms
  • (6e)-6-[[4-[(e)-2-[4-[(2z)-2-(2-carboxy-6-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)hydrazinyl]-2-sulfo-phenyl]ethenyl]-3-sulfo-phenyl]hydrazinylidene]-5-hydroxy-3-oxo-cyclohexa-1,4-diene-1-carboxylic acid
  • (6e)-6-[[4-[(e)-2-[4-[(n'z)-n'-(2-carboxy-6-hydroxy-4-keto-1-cyclohexa-2,5-dienylidene)hydrazino]-2-sulfo-phenyl]vinyl]-3-sulfo-phenyl]hydrazono]-5-hydroxy-3-keto-cyclohexa-1,4-diene-1-carboxylic acid
  • (6e)-6-[[4-[(e)-2-[4-[(n'z)-n'-(2-carboxy-6-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)hydrazino]-2-sulfo-phenyl]vinyl]-3-sulfo-phenyl]hydrazono]-5-hydroxy-3-oxo-cyclohexa-1,4-diene-1-carboxylic acid
  • (6e)-6-[[4-[(e)-2-[4-[(n'z)-n'-(2-carboxy-6-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)hydrazino]-2-sulfophenyl]vinyl]-3-sulfophenyl]hydrazono]-5-hydroxy-3-oxo-1-cyclohexa-1,4-dienecarboxylic acid
  • 164416-13-1 (tetrasodium salt)
  • 4,4'-bis(2-carboxy-4,6-dihydroxyphenylazo)stilbene-2,2'-disulfonic acid (*tetrasodium salt*)
  • benzoic acid, 2,2'-[(1e)-1,2-ethenediylbis[(1e)-(3-sulfo-4,1-phenylene)azo]]bis[3,5-dihydroxy-
  • resobene (*tetrasodium salt*)
InChIKey OYZYQPNEFXSLIM-YMOBLXCZSA-N
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