4-[4-(Acetylamino)Anilino]-1-Amino-9,10-Dihydro-9,10-Dioxoanthracene-2,6-Disulphonic Acid
[CAS# 97549-02-5]

Identification

• Name: 4-[4-(Acetylamino)Anilino]-1-Amino-9,10-Dihydro-9,10-Dioxoanthracene-2,6-Disulphonic Acid
• Synonyms: 4-[(4-Acetamidophenyl)Amino]-1-Amino-9,10-Dioxo-Anthracene-2,6-Disulfonic Acid; 4-[(4-Acetamidophenyl)Amino]-1-Amino-9,10-Diketo-Anthracene-2,6-Disulfonic Acid
• Molecular Formula: C₂₂H₁₇N₃O₉S₂
• Molecular Weight: 531.51
• CAS Registry Number: 97549-02-5
• EINECS: 307-098-7
• SMILES: C4=C(NC1=CC=C(NC(=O)C)C=C1)C2=C(C(=O)C3=C(C2=O)C=C([S](=O)(=O)O)C=C3)C(=C4[S](=O)(=O)O)N
• InChI: 1S/C22H17N3O9S2/c1-10(26)24-11-2-4-12(5-3-11)25-16-9-17(36(32,33)34)20(23)19-18(16)22(28)15-8-13(35(29,30)31)6-7-14(15)21(19)27/h2-9,25H,23H2,1H3,(H,24,26)(H,29,30,31)(H,32,33,34)
• InChIKey: MOQRDWUCKHSLCR-UHFFFAOYSA-N

Properties

• Density: 1.737g/cm³ (Cal.)