2-[1-Amino-9,10-Bis(Sulphooxy)-2-Anthryl]Anthra[2,3-d]Oxazole-5,10-Diyl Bis(Hydrogen Sulphate)
[CAS# 4568-45-0]

Identification

• Name: 2-[1-Amino-9,10-Bis(Sulphooxy)-2-Anthryl]Anthra[2,3-d]Oxazole-5,10-Diyl Bis(Hydrogen Sulphate)
• Synonyms: [1-Amino-2-(5,10-Disulfooxynaphtho[3,2-F][1,3]Benzoxazol-2-Yl)-10-Sulfooxy-9-Anthryl] Hydrogen Sulfate; [1-Amino-2-(5,10-Disulfooxy-2-Naphtho[3,2-F][1,3]Benzoxazolyl)-10-Sulfooxy-9-Anthryl] Hydrogen Sulfate; [1-Amino-2-(5,10-Disulfoxynaphtho[3,2-F][1,3]Benzoxazol-2-Yl)-10-Sulfoxy-9-Anthryl] Hydrogen Sulfate
• Molecular Formula: C₂₉H₁₈N₂O₁₇S₄
• Molecular Weight: 794.70
• CAS Registry Number: 4568-45-0
• EINECS: 224-946-0
• SMILES: C1=C6C(=CC5=C1N=C(C4=C(C3=C(C2=CC=CC=C2C(=C3C=C4)O[S](=O)(=O)O)O[S](=O)(=O)O)N)O5)C(=C7C(=C6O[S](=O)(=O)O)C=CC=C7)O[S](=O)(=O)O
• InChI: 1S/C29H18N2O17S4/c30-24-18(10-9-17-23(24)28(48-52(41,42)43)16-8-4-3-7-15(16)25(17)45-49(32,33)34)29-31-21-11-19-20(12-22(21)44-29)27(47-51(38,39)40)14-6-2-1-5-13(14)26(19)46-50(35,36)37/h1-12H,30H2,(H,32,33,34)(H,35,36,37)(H,38,39,40)(H,41,42,43)
• InChIKey: QZXVIVPPIIRMCP-UHFFFAOYSA-N

Properties

• Density: 1.949g/cm³ (Cal.)