2,5-Dichloro-4-[4-[[5-[(4,6-Dichloro-1,3,5-Triazin-2-Yl)Amino]-2-Sulphophenyl]Azo]-4,5-Dihydro-3-Methyl-5-Oxo-1H-Pyrazol-1-Yl]Benzenesulphonic Acid
[CAS# 25489-31-0]

Identification

• Name: 2,5-Dichloro-4-[4-[[5-[(4,6-Dichloro-1,3,5-Triazin-2-Yl)Amino]-2-Sulphophenyl]Azo]-4,5-Dihydro-3-Methyl-5-Oxo-1H-Pyrazol-1-Yl]Benzenesulphonic Acid
• Synonyms: 2,5-Dichloro-4-[4-[4-[(4,6-Dichloro-1,3,5-Triazin-2-Yl)Amino]-2-Sulfo-Phenyl]Azo-3-Methyl-5-Oxo-4H-Pyrazol-1-Yl]Benzenesulfonic Acid; 2,5-Dichloro-4-[4-[4-[(4,6-Dichloro-1,3,5-Triazin-2-Yl)Amino]-2-Sulfophenyl]Azo-3-Methyl-5-Oxo-4H-Pyrazol-1-Yl]Benzenesulfonic Acid; 2,5-Dichloro-4-[4-[4-[(4,6-Dichloro-S-Triazin-2-Yl)Amino]-2-Sulfo-Phenyl]Azo-5-Keto-3-Methyl-4H-Pyrazol-1-Yl]Benzenesulfonic Acid
• Molecular Formula: C₁₉H₁₂Cl₄N₈O₇S₂
• Molecular Weight: 670.29
• CAS Registry Number: 25489-31-0
• EINECS: 247-025-5
• SMILES: C1=C([S](=O)(=O)O)C(=CC(=C1Cl)N2C(C(C(=N2)C)N=NC4=C([S](=O)(=O)O)C=C(NC3=NC(=NC(=N3)Cl)Cl)C=C4)=O)Cl
• InChI: 1S/C19H12Cl4N8O7S2/c1-7-15(16(32)31(30-7)12-5-10(21)13(6-9(12)20)39(33,34)35)29-28-11-3-2-8(4-14(11)40(36,37)38)24-19-26-17(22)25-18(23)27-19/h2-6,15H,1H3,(H,33,34,35)(H,36,37,38)(H,24,25,26,27)
• InChIKey: WCTIHMSDUHSUHQ-UHFFFAOYSA-N

Properties

• Density: 1.993g/cm³ (Cal.)