5-({4-Chloro-6-[methyl(phenyl)amino]-1,3,5-triazin-2-yl}amino)-4-hydroxy-3-[(2-sulfophenyl)diazenyl]-2,7-naphthalenedisulfonic acid
[CAS# 69571-19-3]

Identification

• Name: 5-({4-Chloro-6-[methyl(phenyl)amino]-1,3,5-triazin-2-yl}amino)-4-hydroxy-3-[(2-sulfophenyl)diazenyl]-2,7-naphthalenedisulfonic acid
• Synonyms: 2,7-Naphthalenedisulfonic acid, 5-[[4-chloro-6-(methylphenylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-sulfophenyl)azo]-
• Molecular Formula: C₂₆H₂₀ClN₇O₁₀S₃
• Molecular Weight: 722.13
• CAS Registry Number: 69571-19-3
• SMILES: CN(c1ccccc1)c2nc(nc(n2)Cl)Nc3cc(cc4c3c(c(c(c4)S(=O)(=O)O)N=Nc5ccccc5S(=O)(=O)O)O)S(=O)(=O)O
• InChI: 1S/C26H20ClN7O10S3/c1-34(15-7-3-2-4-8-15)26-30-24(27)29-25(31-26)28-18-13-16(45(36,37)38)11-14-12-20(47(42,43)44)22(23(35)21(14)18)33-32-17-9-5-6-10-19(17)46(39,40)41/h2-13,35H,1H3,(H,36,37,38)(H,39,40,41)(H,42,43,44)(H,28,29,30,31)
• InChIKey: RSCFBSYAPQOCQT-UHFFFAOYSA-N

Properties

• Density: 1.784g/cm³ (Cal.)