CAS 116-76-7

1,4-Bis[(9,10-dihydro-9,10-dioxo-1-anthracenyl)amino]-9,10-anthracenedione

Description:

1,4-Bis[(9,10-dihydro-9,10-dioxo-1-anthracenyl)amino]-9,10-anthracenedione, commonly referred to as "DAB," is a synthetic organic compound notable for its distinct anthraquinone structure. This compound features two amino groups attached to the anthracene backbone, which enhances its reactivity and potential applications in various fields, including organic electronics and dye chemistry. DAB exhibits strong absorption in the ultraviolet-visible spectrum, making it useful as a dye and in photonic applications. Its molecular structure contributes to its stability and solubility in organic solvents, while its ability to form charge-transfer complexes can be exploited in electronic devices. Additionally, DAB has been studied for its potential biological activities, including antitumor properties, due to its interaction with cellular components. However, handling this compound requires caution, as it may pose health risks, and appropriate safety measures should be observed in laboratory settings. Overall, DAB is a versatile compound with significant implications in both industrial and research applications.

Formula: C₄₂H₂₂N₂O₆

InChI: InChI=1S/C42H22N2O6/c45-37-21-9-1-3-11-23(21)39(47)33-27(37)15-7-17-29(33)43-31-19-20-32(36-35(31)41(49)25-13-5-6-14-26(25)42(36)50)44-30-18-8-16-28-34(30)40(48)24-12-4-2-10-22(24)38(28)46/h1-20,43-44H

InChI key: InChIKey=APWOKAUQXMGVOF-UHFFFAOYSA-N

SMILES: N(C1=C2C(=C(NC3=C4C(C(=O)C=5C(C4=O)=CC=CC5)=CC=C3)C=C1)C(=O)C=6C(C2=O)=CC=CC6)C7=C8C(C(=O)C=9C(C8=O)=CC=CC9)=CC=C7

Synonyms:

• 1,1′,4′,1′′-Trianthrimide
• NSC 84171
• 9,10-Anthracenedione, 1,4-bis[(9,10-dihydro-9,10-dioxo-1-anthracenyl)amino]-
• Anthraquinone, 1,4-bis(1-anthraquinonylamino)-
• 1,4-Bis[(9,10-dihydro-9,10-dioxo-1-anthracenyl)amino]-9,10-anthracenedione