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CAS 51858-17-4

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1H-Pyrazole-3-carboxylic acid, 4-[5-[3-carboxy-1,5-dihydro-5-oxo-1-(4-sulfophenyl)-4H-pyrazol-4-ylidene]-1,3-pentadien-1-yl]-5-hydroxy-1-(4-sulfophenyl)-, potassium salt (1:2)

Description:
1H-Pyrazole-3-carboxylic acid, 4-[5-[3-carboxy-1,5-dihydro-5-oxo-1-(4-sulfophenyl)-4H-pyrazol-4-ylidene]-1,3-pentadien-1-yl]-5-hydroxy-1-(4-sulfophenyl)-, potassium salt (1:2), with CAS number 51858-17-4, is a complex organic compound characterized by its pyrazole core structure, which is a five-membered ring containing two nitrogen atoms. This compound features multiple functional groups, including carboxylic acid and sulfonic acid moieties, contributing to its solubility in water and potential biological activity. The presence of potassium as a counterion suggests that it may exhibit ionic properties, enhancing its solubility in aqueous environments. The compound's structure indicates potential applications in pharmaceuticals or agrochemicals, particularly due to its ability to interact with biological systems. Its stability, reactivity, and specific interactions would depend on the pH and the presence of other ions or molecules in solution. Overall, this compound represents a unique class of pyrazole derivatives with potential utility in various chemical and biological applications.
Formula:C25H18N4O12S2·2K
InChI:InChI=1S/C25H18N4O12S2.2K/c30-22-18(20(24(32)33)26-28(22)14-6-10-16(11-7-14)42(36,37)38)4-2-1-3-5-19-21(25(34)35)27-29(23(19)31)15-8-12-17(13-9-15)43(39,40)41;;/h1-13,30H,(H,32,33)(H,34,35)(H,36,37,38)(H,39,40,41);;
InChI key:InChIKey=WEHHVEQJFBGZBS-UHFFFAOYSA-N
SMILES:O=C1N(N=C(C(O)=O)C1=CC=CC=CC=2C(C(O)=O)=NN(C2O)C3=CC=C(S(=O)(=O)O)C=C3)C4=CC=C(S(=O)(=O)O)C=C4.[K]
Synonyms:
  • 1,1-Bis(4-sulfophenyl)-3,3-dicarboxy-5,5-dihydroxypyrazolo-4,4-pentamethineoxonole dipotassium salt
  • 1H-Pyrazole-3-carboxylic acid, 4-[5-[3-carboxy-1,5-dihydro-5-oxo-1-(4-sulfophenyl)-4H-pyrazol-4-ylidene]-1,3-pentadien-1-yl]-5-hydroxy-1-(4-sulfophenyl)-, potassium salt (1:2)
  • 1H-Pyrazole-3-carboxylic acid, 4-[5-[3-carboxy-5-hydroxy-1-(4-sulfophenyl)-1H-pyrazol-4-yl]-2,4-pentadienylidene]-4,5-dihydro-5-oxo-1-(4-sulfophenyl)-, dipotassium salt
  • Oxonol Blue
  • dipotassium 4-{(1E,3E,5Z)-5-[3-carboxy-5-oxo-1-(4-sulfophenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]penta-1,3-dien-1-yl}-5-oxo-1-(4-sulfonatophenyl)-2,5-dihydro-1H-pyrazole-3-carboxylate
  • Oxonole Blue dipotassium salt
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