1-Amino-4-[(3-Amino-2,4,6-Trimethyl-5-Sulfophenyl)Amino]-9,10-Dioxo-9,10-Dihydro-2-Anthracenesulfonic Acid
[CAS# 2465-56-7]

Identification

• Name: 1-Amino-4-[(3-Amino-2,4,6-Trimethyl-5-Sulfophenyl)Amino]-9,10-Dioxo-9,10-Dihydro-2-Anthracenesulfonic Acid
• Synonyms: 1-amino-4-(3-amino-2,4,6-trimethyl-5-sulphoanilino)-9,10-dihydro-9,10-dioxoanthracene-2-sulphonic acid
• Molecular Formula: C₂₃H₂₁N₃O₈S₂
• Molecular Weight: 531.56
• CAS Registry Number: 2465-56-7
• SMILES: O=S(=O)(O)c1c(c(c(c(N)c1C)C)Nc4c3C(=O)c2ccccc2C(=O)c3c(c(c4)S(=O)(=O)O)N)C
• InChI: 1S/C23H21N3O8S2/c1-9-18(24)10(2)23(36(32,33)34)11(3)20(9)26-14-8-15(35(29,30)31)19(25)17-16(14)21(27)12-6-4-5-7-13(12)22(17)28/h4-8,26H,24-25H2,1-3H3,(H,29,30,31)(H,32,33,34)
• InChIKey: LQWXDEOZWGMSAR-UHFFFAOYSA-N

Properties

• Density: 1.64g/cm³ (Cal.)
• Refractive index: 1.728 (Cal.)