Hexasodium 2-[[4-[Bis(2-Hydroxypropyl)Amino]-6-[4-[2-[4-[[4-[Bis(2-Hydroxypropyl)Amino]-6-(2,5-Disulfonatoanilino)-1,3,5-Triazin-2-Yl]Amino]-2-Sulfonato-Phenyl]Vinyl]-3-Sulfonato-Anilino]-1,3,5-Triazin-2-Yl]Amino]Benzene-1,4-Disulfonate
[CAS# 371756-75-1]

Identification

• Name: Hexasodium 2-[[4-[Bis(2-Hydroxypropyl)Amino]-6-[4-[2-[4-[[4-[Bis(2-Hydroxypropyl)Amino]-6-(2,5-Disulfonatoanilino)-1,3,5-Triazin-2-Yl]Amino]-2-Sulfonato-Phenyl]Vinyl]-3-Sulfonato-Anilino]-1,3,5-Triazin-2-Yl]Amino]Benzene-1,4-Disulfonate
• Synonyms: 1,4-Benzenedisulfonic acid, 2,2'-[1,2-ethenediylbis[(3-sulfo-4,1-phenylene)imino[6-[bis(2-hydroxypropyl)amino]-1,3,5-triazine-4,2-diyl]imino]]bis-, hexasodium salt
• Molecular Formula: C₄₄H₄₆N₁₂Na₆O₂₂S₆
• Molecular Weight: 1425.23
• CAS Registry Number: 371756-75-1
• SMILES: CC(CN(CC(C)O)c1nc(nc(n1)Nc2cc(ccc2S(=O)(=O)[O-])S(=O)(=O)[O-])Nc3ccc(c(c3)S(=O)(=O)[O-])C=Cc4ccc(cc4S(=O)(=O)[O-])Nc5nc(nc(n5)N(CC(C)O)CC(C)O)Nc6cc(ccc6S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
• InChI: 1S/C44H52N12O22S6.6Na/c1-23(57)19-55(20-24(2)58)43-51-39(49-41(53-43)47-33-17-31(79(61,62)63)11-13-35(33)81(67,68)69)45-29-9-7-27(37(15-29)83(73,74)75)5-6-28-8-10-30(16-38(28)84(76,77)78)46-40-50-42(54-44(52-40)56(21-25(3)59)22-26(4)60)48-34-18-32(80(64,65)66)12-14-36(34)82(70,71)72;;;;;;/h5-18,23-26,57-60H,19-22H2,1-4H3,(H,61,62,63)(H,64,65,66)(H,67,68,69)(H,70,71,72)(H,73,74,75)(H,76,77,78)(H2,45,47,49,51,53)(H2,46,48,50,52,54);;;;;;/q;6*+1/p-6
• InChIKey: AYMQVSYJLSBNAF-UHFFFAOYSA-H

Properties

• Refractive index: (Cal.)