Direct Green 59
[CAS# 7219-11-6]

Identification

• Classification: Dyes and pigments >> Dyes >> Direct dye
• Name: Direct Green 59
• Synonyms: Cuprophenyl Green G; Benzoic Acid, 5-((4-((8-((4-((4-((3-Carboxy-4-Hydroxyphenyl)Azo)Phenyl)Amino)-6-(Phenylamino)-1,3,5-Triazin-2-Yl)Amino)-1-Hydroxy-3,6-Disulfo-2-Naphthalenyl)Azo)-5-Methoxy-2-Methylphenyl)Azo)-2-Hydroxy-3-Sulfo-, Pentasodium Salt
• Molecular Formula: C₄₇H₃₁N₁₂Na₅O₁₇S₃
• Molecular Weight: 1246.96
• CAS Registry Number: 7219-11-6
• EINECS: 230-617-2
• SMILES: C1=C([S](=O)(=O)[O-])C(=C(C2=C1C=C([S](=O)(=O)[O-])C=C2NC3=NC(=NC(=N3)NC5=CC=C(N=NC4=CC(=C(O)C=C4)C(=O)[O-])C=C5)NC6=CC=CC=C6)O)N=NC7=CC(=C(C=C7OC)N=NC8=CC(=C(C(=C8)[S](=O)(=O)[O-])O)C(=O)[O-])C.[Na+].[Na+].[Na+].[Na+].[Na+]
• InChI: 1S/C47H36N12O17S3.5Na/c1-22-14-33(36(76-2)21-32(22)57-56-28-18-31(44(65)66)41(61)38(19-28)79(73,74)75)58-59-40-37(78(70,71)72)16-23-15-29(77(67,68)69)20-34(39(23)42(40)62)50-47-52-45(48-24-6-4-3-5-7-24)51-46(53-47)49-25-8-10-26(11-9-25)54-55-27-12-13-35(60)30(17-27)43(63)64;;;;;/h3-21,60-62H,1-2H3,(H,63,64)(H,65,66)(H,67,68,69)(H,70,71,72)(H,73,74,75)(H3,48,49,50,51,52,53);;;;;/q;5*+1/p-5
• InChIKey: QLKQKKXODVPPLY-UHFFFAOYSA-I