Tetrasodium 4-(3-(3-carboxylato-5-hydroxy-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl)allylidene)-4,5-dihydro-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazole-3-carboxylate | CAS No. 70024-44-1

Tetrasodium 4-(3-(3-carboxylato-5-hydroxy-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl)allylidene)-4,5-dihydro-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazole-3-carboxylate

Basic Information

CAS Number

70024-44-1

Molecular Formula

C23H12N4Na4O12S2

Molecular Weight

692.5 g/mol

AD

Basic Physical Properties

C1=CC(=CC=C1N2C(=C(C(=O)N2)C=CC=C3C(=NN(C3=O)C4=CC=C(C=C4)S(=O)(=O)[O-])C(=O)[O-])C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/C23H16N4O12S2.4Na/c28-20-17(19(23(32)33)26(25-20)12-4-8-14(9-5-12)40(34,35)36)3-1-2-16-18(22(30)31)24-27(21(16)29)13-6-10-15(11-7-13)41(37,38)39;;;;/h1-11H,(H,25,28)(H,30,31)(H,32,33)(H,34,35,36)(H,37,38,39);;;;/q;4*+1/p-4/b3-1+,16-2-;;;;

InChIKey

DAQULUJZJRYRPJ-FAEJZUITSA-J

LogP

-1.63840

Complexity

1450

Synonyms & References

English

  • 70024-44-1
  • DTXSID50220312
  • EINECS 274-257-4
  • Tetrasodium 4-(3-(3-carboxylato-5-hydroxy-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl)allylidene)-4,5-dihydro-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazole-3-carboxylate
  • 1H-Pyrazole-3-carboxylicacid,4-[3-[3-carboxy-1,5-dihydro-5-oxo-1-(4-sulfophenyl)-4H-pyrazol-4-ylidene]-1-propen-1-yl]-5-hydroxy-1-(4-sulfophenyl)-,sodium salt (1:4)
  • 1,1'-BIS(4-SULFOPHENYL)-3,3'-DICARBOXY-5,5'-DIHYDROXYPYRAZOLO-4,4'-TRIMETHINE OXONOLE TETRASODIUM SALT
  • 1H-Pyrazole-3-carboxylicacid,4-[3-[3-carboxy-1,5-dihydro-5-oxo-1-(4-sulfophenyl)-4H-pyrazol-4-ylidene]-1-propen-1-yl]-5-hydro
  • tetrasodium,(4Z)-4-[(E)-3-[3-carboxylato-5-oxo-2-(4-sulfonatophenyl)-1H-pyrazol-4-yl]prop-2-enylidene]-5-oxo-1-(4-sulfonatophenyl)pyrazole-3-carboxylate

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