m-Tolyl 4-[(1-Amino-9,10-Dihydro-4-Hydroxy-9,10-Dioxo-2-Anthryl)Oxy]Benzenesulphonate
[CAS# 5517-35-1]

Identification

• Name: m-Tolyl 4-[(1-Amino-9,10-Dihydro-4-Hydroxy-9,10-Dioxo-2-Anthryl)Oxy]Benzenesulphonate
• Synonyms: (3-Methylphenyl) 4-[(1-Amino-4-Hydroxy-9,10-Dioxo-2-Anthryl)Oxy]Benzenesulfonate; 4-[(1-Amino-4-Hydroxy-9,10-Dioxo-2-Anthryl)Oxy]Benzenesulfonic Acid (3-Methylphenyl) Ester; 4-[(1-Amino-4-Hydroxy-9,10-Diketo-2-Anthryl)Oxy]Benzenesulfonic Acid (3-Methylphenyl) Ester
• Molecular Formula: C₂₇H₁₉NO₇S
• Molecular Weight: 501.51
• CAS Registry Number: 5517-35-1
• EINECS: 226-863-5
• SMILES: C3=C(O)C1=C(C(=O)C2=C(C1=O)C=CC=C2)C(=C3OC5=CC=C([S](OC4=CC(=CC=C4)C)(=O)=O)C=C5)N
• InChI: 1S/C27H19NO7S/c1-15-5-4-6-17(13-15)35-36(32,33)18-11-9-16(10-12-18)34-22-14-21(29)23-24(25(22)28)27(31)20-8-3-2-7-19(20)26(23)30/h2-14,29H,28H2,1H3
• InChIKey: GDBXXYSGUYHFMZ-UHFFFAOYSA-N

Properties

• Density: 1.474g/cm³ (Cal.)
• Boiling point: 737.361°C at 760 mmHg (Cal.)
• Flash point: 399.742°C (Cal.)