5-[[4-[[4-[[4-[(4-Amino-9,10-Dihydro-9,10-Dioxo-3-Sulpho-1-Anthryl)Amino]-2-Sulphophenyl]Amino]-6-(Phenylamino)-1,3,5-Triazin-2-Yl]Amino]Phenyl]Azo]-2-Hydroxybenzoic Acid
[CAS# 62572-84-3]

Identification

• Name: 5-[[4-[[4-[[4-[(4-Amino-9,10-Dihydro-9,10-Dioxo-3-Sulpho-1-Anthryl)Amino]-2-Sulphophenyl]Amino]-6-(Phenylamino)-1,3,5-Triazin-2-Yl]Amino]Phenyl]Azo]-2-Hydroxybenzoic Acid
• Synonyms: (3Z)-3-[[4-[[4-[[4-[(4-Amino-9,10-Dioxo-3-Sulfo-1-Anthryl)Amino]-2-Sulfo-Phenyl]Amino]-6-(Phenylamino)-1,3,5-Triazin-2-Yl]Amino]Phenyl]Hydrazono]-6-Oxo-Cyclohexa-1,4-Diene-1-Carboxylic Acid; (3Z)-3-[[4-[[4-[[4-[(4-Amino-9,10-Dioxo-3-Sulfo-1-Anthryl)Amino]-2-Sulfophenyl]Amino]-6-(Phenylamino)-1,3,5-Triazin-2-Yl]Amino]Phenyl]Hydrazono]-6-Oxo-1-Cyclohexa-1,4-Dienecarboxylic Acid; (3Z)-3-[[4-[[4-[[4-[(4-Amino-9,10-Diketo-3-Sulfo-1-Anthryl)Amino]-2-Sulfo-Phenyl]Amino]-6-(Phenylamino)-S-Triazin-2-Yl]Amino]Phenyl]Hydrazono]-6-Keto-Cyclohexa-1,4-Diene-1-Carboxylic Acid
• Molecular Formula: C₄₂H₃₀N₁₀O₁₁S₂
• Molecular Weight: 914.88
• CAS Registry Number: 62572-84-3
• EINECS: 263-610-8
• SMILES: C6=C(NC5=CC(=C(NC1=NC(=NC(=N1)NC3=CC=C(N\N=C2/C=C(C(=O)C=C2)C(O)=O)C=C3)NC4=CC=CC=C4)C=C5)[S](O)(=O)=O)C8=C(C(=C6[S](O)(=O)=O)N)C(=O)C7=CC=CC=C7C8=O
• InChI: 1S/C42H30N10O11S2/c43-36-33(65(61,62)63)20-30(34-35(36)38(55)27-9-5-4-8-26(27)37(34)54)44-24-14-16-29(32(19-24)64(58,59)60)47-42-49-40(45-21-6-2-1-3-7-21)48-41(50-42)46-22-10-12-23(13-11-22)51-52-25-15-17-31(53)28(18-25)39(56)57/h1-20,44,51H,43H2,(H,56,57)(H,58,59,60)(H,61,62,63)(H3,45,46,47,48,49,50)/b52-25-
• InChIKey: UAQTZUDKHOYICJ-BTCVTZJHSA-N

Properties

• Density: 1.699g/cm³ (Cal.)