Disodium 7-[(4,6-Bis{[3-(Diethylamino)Propyl]Amino}-1,3,5-Triazin-2-Yl)Amino]-4-Hydroxy-3-({4-[(4-Sulfonatophenyl)Diazenyl]Phenyl}Diazenyl)-2-Naphthalenesulfonate
[CAS# 120029-06-3]

Identification

• Name: Disodium 7-[(4,6-Bis{[3-(Diethylamino)Propyl]Amino}-1,3,5-Triazin-2-Yl)Amino]-4-Hydroxy-3-({4-[(4-Sulfonatophenyl)Diazenyl]Phenyl}Diazenyl)-2-Naphthalenesulfonate
• Synonyms: 2-Naphthalenesulfonic acid, 7-[[4,6-bis[[3-(diethylamino)propyl]amino]-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[[4-[(4-sulfophenyl)azo]phenyl]azo]-, disodium salt
• Molecular Formula: C₃₉H₄₈N₁₂Na₂O₇S₂
• Molecular Weight: 906.98
• CAS Registry Number: 120029-06-3
• SMILES: CCN(CC)CCCNc1nc(nc(n1)Nc2ccc3c(c2)cc(c(c3O)N=Nc4ccc(cc4)N=Nc5ccc(cc5)S(=O)(=O)[O-])S(=O)(=O)[O-])NCCCN(CC)CC.[Na+].[Na+]
• InChI: 1S/C39H50N12O7S2.2Na/c1-5-50(6-2)23-9-21-40-37-43-38(41-22-10-24-51(7-3)8-4)45-39(44-37)42-31-17-20-33-27(25-31)26-34(60(56,57)58)35(36(33)52)49-48-29-13-11-28(12-14-29)46-47-30-15-18-32(19-16-30)59(53,54)55;;/h11-20,25-26,52H,5-10,21-24H2,1-4H3,(H,53,54,55)(H,56,57,58)(H3,40,41,42,43,44,45);;/q;2*+1/p-2
• InChIKey: DDHFUTFJWQQVPR-UHFFFAOYSA-L

Properties

• Refractive index: (Cal.)