5-Methyl-2-[[4-[(4-Methyl-2-Sulfophenyl)Amino]-9,10-Dioxoanthracen-1-Yl]Amino]Benzenesulfonic Acid
[CAS# 3443-90-1]

Identification

• Name: 5-Methyl-2-[[4-[(4-Methyl-2-Sulfophenyl)Amino]-9,10-Dioxoanthracen-1-Yl]Amino]Benzenesulfonic Acid
• Synonyms: 5-Methyl-2-[[4-[(4-Methyl-2-Sulfo-Phenyl)Amino]-9,10-Dioxo-1-Anthryl]Amino]Benzenesulfonic Acid; 5-Methyl-2-[[4-[(4-Methyl-2-Sulfophenyl)Amino]-9,10-Dioxo-1-Anthryl]Amino]Benzenesulfonic Acid; 2-[[9,10-Diketo-4-[(4-Methyl-2-Sulfo-Phenyl)Amino]-1-Anthryl]Amino]-5-Methyl-Benzenesulfonic Acid
• Molecular Formula: C₂₈H₂₂N₂O₈S₂
• Molecular Weight: 578.61
• CAS Registry Number: 3443-90-1
• SMILES: C1=CC(=C3C(=C1NC2=C(C=C(C)C=C2)[S](O)(=O)=O)C(C4=C(C3=O)C=CC=C4)=O)NC5=C(C=C(C)C=C5)[S](O)(=O)=O
• InChI: 1S/C28H22N2O8S2/c1-15-7-9-19(23(13-15)39(33,34)35)29-21-11-12-22(30-20-10-8-16(2)14-24(20)40(36,37)38)26-25(21)27(31)17-5-3-4-6-18(17)28(26)32/h3-14,29-30H,1-2H3,(H,33,34,35)(H,36,37,38)
• InChIKey: BGBDMEPBLWJCHI-UHFFFAOYSA-N

Properties

• Density: 1.567g/cm³ (Cal.)