N-[4-[[5-(Benzoylamino)-9,10-Dioxoanthracen-1-Yl]Amino]-9,10-Dioxoanthracen-1-Yl]Benzamide
[CAS# 128-89-2]

Identification

• Name: N-[4-[[5-(Benzoylamino)-9,10-Dioxoanthracen-1-Yl]Amino]-9,10-Dioxoanthracen-1-Yl]Benzamide
• Synonyms: N-[4-[[5-(Benzoylamino)-9,10-Dioxo-1-Anthryl]Amino]-9,10-Dioxo-1-Anthryl]Benzamide; N-[4-[[9,10-Dioxo-5-[(Oxo-Phenylmethyl)Amino]-1-Anthryl]Amino]-9,10-Dioxo-1-Anthryl]Benzamide; N-[4-[[5-(Benzoylamino)-9,10-Diketo-1-Anthryl]Amino]-9,10-Diketo-1-Anthryl]Benzamide
• Molecular Formula: C₄₂H₂₅N₃O₆
• Molecular Weight: 667.68
• CAS Registry Number: 128-89-2
• EINECS: 204-916-3
• SMILES: C1=CC(=C6C(=C1NC2=C3C(=CC=C2)C(C4=C(C3=O)C=CC=C4NC(C5=CC=CC=C5)=O)=O)C(C7=C(C6=O)C=CC=C7)=O)NC(C8=CC=CC=C8)=O
• InChI: 1S/C42H25N3O6/c46-37-25-15-7-8-16-26(25)38(47)36-32(45-42(51)24-13-5-2-6-14-24)22-21-31(35(36)37)43-29-19-9-17-27-33(29)39(48)28-18-10-20-30(34(28)40(27)49)44-41(50)23-11-3-1-4-12-23/h1-22,43H,(H,44,50)(H,45,51)
• InChIKey: HZCNWAWXJDZEHZ-UHFFFAOYSA-N

Properties

• Density: 1.476g/cm³ (Cal.)
• Boiling point: 778.489°C at 760 mmHg (Cal.)
• Flash point: 175.444°C (Cal.)