3-[[5-[(4,6-Dichloro-1,3,5-Triazin-2-Yl)Amino]-2-Sulphophenyl]Azo]-1,2-Dihydro-6-Hydroxy-2-Oxoisonicotinic Acid
[CAS# 67400-78-6]

Identification

• Name: 3-[[5-[(4,6-Dichloro-1,3,5-Triazin-2-Yl)Amino]-2-Sulphophenyl]Azo]-1,2-Dihydro-6-Hydroxy-2-Oxoisonicotinic Acid
• Synonyms: (3E)-3-[[5-[(4,6-Dichloro-1,3,5-Triazin-2-Yl)Amino]-2-Sulfo-Phenyl]Hydrazono]-2,6-Dioxo-Pyridine-4-Carboxylic Acid; (3E)-3-[[5-[(4,6-Dichloro-1,3,5-Triazin-2-Yl)Amino]-2-Sulfophenyl]Hydrazono]-2,6-Dioxo-4-Pyridinecarboxylic Acid; (3E)-3-[[5-[(4,6-Dichloro-S-Triazin-2-Yl)Amino]-2-Sulfo-Phenyl]Hydrazono]-2,6-Diketo-Isonicotinic Acid
• Molecular Formula: C₁₅H₉Cl₂N₇O₇S
• Molecular Weight: 502.24
• CAS Registry Number: 67400-78-6
• EINECS: 266-681-3
• SMILES: C2=C(NC1=NC(=NC(=N1)Cl)Cl)C=CC(=C2N\N=C3/C(=CC(=O)NC3=O)C(O)=O)[S](O)(=O)=O
• InChI: 1S/C15H9Cl2N7O7S/c16-13-20-14(17)22-15(21-13)18-5-1-2-8(32(29,30)31)7(3-5)23-24-10-6(12(27)28)4-9(25)19-11(10)26/h1-4,23H,(H,27,28)(H,19,25,26)(H,29,30,31)(H,18,20,21,22)/b24-10+
• InChIKey: OQDQPBGTSWRSGU-YSURURNPSA-N

Properties

• Density: 2.037g/cm³ (Cal.)