(4E)-4-[(2E,4E)-5-[3-Carboxy-5-Oxo-1-(4-Sulfophenyl)-2H-Pyrazol-4-Yl]Penta-2,4-Dienylidene]-5-Oxo-1-(4-Sulfophenyl)Pyrazole-3-Carboxylic Acid
[CAS# 32425-62-0]

Identification

• Name: (4E)-4-[(2E,4E)-5-[3-Carboxy-5-Oxo-1-(4-Sulfophenyl)-2H-Pyrazol-4-Yl]Penta-2,4-Dienylidene]-5-Oxo-1-(4-Sulfophenyl)Pyrazole-3-Carboxylic Acid
• Synonyms: 4-[5-[3-Carboxy-5-Oxo-1-(4-Sulfophenyl)-2H-Pyrazol-4-Yl]Penta-2,4-Dienylidene]-5-Oxo-1-(4-Sulfophenyl)Pyrazole-3-Carboxylic Acid; (4E)-4-[(2E,4E)-5-[3-Carboxy-5-Oxo-1-(4-Sulfophenyl)-2H-Pyrazol-4-Yl]Penta-2,4-Dienylidene]-5-Oxo-1-(4-Sulfophenyl)-3-Pyrazolecarboxylic Acid; 4-[5-[3-Carboxy-5-Oxo-1-(4-Sulfophenyl)-2H-Pyrazol-4-Yl]Penta-2,4-Dienylidene]-5-Oxo-1-(4-Sulfophenyl)-3-Pyrazolecarboxylic Acid
• Molecular Formula: C₂₅H₁₈N₄O₁₂S₂
• Molecular Weight: 630.56
• CAS Registry Number: 32425-62-0
• EINECS: 251-031-3
• SMILES: C4=C(N1NC(=C(C1=O)\C=C\C=C\C=C2\C(=O)N(N=C2C(O)=O)C3=CC=C([S](O)(=O)=O)C=C3)C(O)=O)C=CC(=C4)[S](O)(=O)=O
• InChI: 1S/C25H18N4O12S2/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/h1-13,26H,(H,32,33)(H,34,35)(H,36,37,38)(H,39,40,41)/b3-1+,4-2+,19-5+
• InChIKey: QKWLWTCFYLNAHC-LZFSOBRNSA-N

Properties

• Density: 1.705g/cm³ (Cal.)