2''-(4-Aminophenyl)-6-Methyl[2,6':2',6''-Terbenzothiazole]-7-Sulfonic Acid
[CAS# 47812-48-6]

Identification

• Name: 2''-(4-Aminophenyl)-6-Methyl[2,6':2',6''-Terbenzothiazole]-7-Sulfonic Acid
• Synonyms: (2,6':2',6''-Terbenzothiazole)-7-Sulfonic Acid, 2''-(4-Aminophenyl)-6-Methyl-
• Molecular Formula: C₂₈H₁₈N₄O₃S₄
• Molecular Weight: 586.72
• CAS Registry Number: 47812-48-6
• SMILES: C2=C(C(=C1SC(=NC1=C2)C3=CC=C4C(=C3)SC(=N4)C5=CC=C6C(=C5)SC(=N6)C7=CC=C(C=C7)N)[S](=O)(=O)O)C
• InChI: 1S/C28H18N4O3S4/c1-14-2-9-21-24(25(14)39(33,34)35)38-28(32-21)17-6-11-20-23(13-17)37-27(31-20)16-5-10-19-22(12-16)36-26(30-19)15-3-7-18(29)8-4-15/h2-13H,29H2,1H3,(H,33,34,35)
• InChIKey: NKNPWUKNWAVDGC-UHFFFAOYSA-N

Properties

• Density: 1.556g/cm³ (Cal.)