5-[[4-Chloro-6-(Phenylamino)-1,3,5-Triazin-2-Yl]Amino]-4-Hydroxy-3-[(2-Sulphophenyl)Azo]Naphthalene-2,7-Disulphonic Acid
[CAS# 29128-95-8]

Identification

• Name: 5-[[4-Chloro-6-(Phenylamino)-1,3,5-Triazin-2-Yl]Amino]-4-Hydroxy-3-[(2-Sulphophenyl)Azo]Naphthalene-2,7-Disulphonic Acid
• Synonyms: (3E)-5-[[4-Chloro-6-(Phenylamino)-1,3,5-Triazin-2-Yl]Amino]-4-Oxo-3-[(2-Sulfophenyl)Hydrazono]Naphthalene-2,7-Disulfonic Acid; (3E)-5-[[4-Chloro-6-(Phenylamino)-S-Triazin-2-Yl]Amino]-4-Keto-3-[(2-Sulfophenyl)Hydrazono]Naphthalene-2,7-Disulfonic Acid; 5-((4-Chloro-6-(Phenylamino)-1,3,5-Triazin-2-Yl)Amino)-4-Hydroxy-3-((2-Sulphophenyl)Azo)Naphthalene-2,7-Disulphonic Acid
• Molecular Formula: C₂₅H₁₈ClN₇O₁₀S₃
• Molecular Weight: 708.09
• CAS Registry Number: 29128-95-8
• EINECS: 249-461-1
• SMILES: C3=C([S](O)(=O)=O)C=C(NC1=NC(=NC(=N1)NC2=CC=CC=C2)Cl)C5=C3C=C([S](O)(=O)=O)/C(=N/NC4=CC=CC=C4[S](O)(=O)=O)C5=O
• InChI: 1S/C25H18ClN7O10S3/c26-23-29-24(27-14-6-2-1-3-7-14)31-25(30-23)28-17-12-15(44(35,36)37)10-13-11-19(46(41,42)43)21(22(34)20(13)17)33-32-16-8-4-5-9-18(16)45(38,39)40/h1-12,32H,(H,35,36,37)(H,38,39,40)(H,41,42,43)(H2,27,28,29,30,31)/b33-21-
• InChIKey: CEHCXHHVHWNGNU-HWIUFGAZSA-N

Properties

• Density: 1.846g/cm³ (Cal.)