2-[3-[(4-Acetamido-9,10-Dioxoanthracen-1-Yl)Amino]-4-Methoxyphenyl]Sulfonylethyl Acetate
[CAS# 79641-31-9]

Identification

• Name: 2-[3-[(4-Acetamido-9,10-Dioxoanthracen-1-Yl)Amino]-4-Methoxyphenyl]Sulfonylethyl Acetate
• Synonyms: 2-[3-[(4-Acetamido-9,10-Dioxo-1-Anthryl)Amino]-4-Methoxy-Phenyl]Sulfonylethyl Acetate; Acetic Acid 2-[3-[(4-Acetamido-9,10-Dioxo-1-Anthryl)Amino]-4-Methoxyphenyl]Sulfonylethyl Ester; Acetic Acid 2-[3-[(4-Acetamido-9,10-Diketo-1-Anthryl)Amino]-4-Methoxy-Phenyl]Sulfonylethyl Ester
• Molecular Formula: C₂₇H₂₄N₂O₈S
• Molecular Weight: 536.56
• CAS Registry Number: 79641-31-9
• EINECS: 279-207-5
• SMILES: C4=C(NC1=C(OC)C=CC(=C1)[S](=O)(=O)CCOC(=O)C)C2=C(C(=O)C3=C(C2=O)C=CC=C3)C(=C4)NC(=O)C
• InChI: 1S/C27H24N2O8S/c1-15(30)28-20-9-10-21(25-24(20)26(32)18-6-4-5-7-19(18)27(25)33)29-22-14-17(8-11-23(22)36-3)38(34,35)13-12-37-16(2)31/h4-11,14,29H,12-13H2,1-3H3,(H,28,30)
• InChIKey: QSUUWOZVFLFFKO-UHFFFAOYSA-N

Properties

• Density: 1.423g/cm³ (Cal.)
• Boiling point: 795.94°C at 760 mmHg (Cal.)
• Flash point: 435.169°C (Cal.)