4-Amino-5-hydroxy-6-[(2-methoxy-5-methyl-4-{[2-(sulfooxy)ethyl]sulfonyl}phenyl)diazenyl]-3-[(4-{[2-(sulfooxy)ethyl]sulfonyl}phenyl)diazenyl]-2,7-naphthalenedisulfonic acid
[CAS# 85959-30-4]

Identification

• Name: 4-Amino-5-hydroxy-6-[(2-methoxy-5-methyl-4-{[2-(sulfooxy)ethyl]sulfonyl}phenyl)diazenyl]-3-[(4-{[2-(sulfooxy)ethyl]sulfonyl}phenyl)diazenyl]-2,7-naphthalenedisulfonic acid
• Synonyms: 4-amino-5-hydroxy-6-[[2-methoxy-5-methyl-4-[[2-(sulphooxy)ethyl]sulphonyl]phenyl]azo]-3-[[4-[[2-(sulphooxy)ethyl]sulphonyl]phenyl]azo]naphthalene-2,7-disulphonic acid
• Molecular Formula: C₂₈H₂₉N₅O₂₀S₆
• Molecular Weight: 947.94
• CAS Registry Number: 85959-30-4
• EINECS: 289-022-1
• SMILES: COc4cc(c(C)cc4N=Nc3c(cc2cc(c(N=Nc1ccc(cc1)S(=O)(=O)CCOS(O)(=O)=O)c(N)c2c3O)S(O)(=O)=O)S(O)(=O)=O)S(=O)(=O)CCOS(O)(=O)=O
• InChI: 1S/C28H29N5O20S6/c1-15-11-19(20(51-2)14-21(15)55(37,38)10-8-53-59(48,49)50)31-33-27-23(57(42,43)44)13-16-12-22(56(39,40)41)26(25(29)24(16)28(27)34)32-30-17-3-5-18(6-4-17)54(35,36)9-7-52-58(45,46)47/h3-6,11-14,34H,7-10,29H2,1-2H3,(H,39,40,41)(H,42,43,44)(H,45,46,47)(H,48,49,50)
• InChIKey: OMXJQNIVFPWVOO-UHFFFAOYSA-N

Properties

• Density: 1.864g/cm³ (Cal.)