96409-74-4

Basic information

• Product Name: Acetamide, N-[3,5-bis[(acetyloxy)methyl]-4-nitrophenyl]-
• CAS NO: 96409-74-4
• Molecular Formula: C14H16N2O7
• Molecular Weight: 324.29
• Mol File: 96409-74-4.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: Acetamide, N-[3,5-bis[(acetyloxy)methyl]-4-nitrophenyl]-(CAS DataBase Reference)
• NIST Chemistry Reference: Acetamide, N-[3,5-bis[(acetyloxy)methyl]-4-nitrophenyl]-(96409-74-4)
• EPA Substance Registry System: Acetamide, N-[3,5-bis[(acetyloxy)methyl]-4-nitrophenyl]-(96409-74-4)

Safety Data

• Hazardous Substances Data: 96409-74-4(Hazardous Substances Data)

Upstream product

• 71176-55-1 5-nitro-m-xylene-(α,α')-diol 
• 36308-36-8 5-nitrobenzene-1,3-dicarbaldehyde 
• 108-24-7 acetic anhydride 
• 71176-54-0 (3-amino-5-hydroxymethylphenyl)methanol 

Downstream Products

• 96409-78-8 1,2-Bis(brommethyl)-2,5-dinitrobenzol 
• 96409-77-7 2,5-Dinitro-1,3-benzoldimethanol 

Relevant articles and documents

Electron Donor-Acceptor Compounds, XXXVIII. Electron Donor-Acceptor Metacyclophanes: Synthesis, Structure, and Charge-Transfer Spectra

Donor-acceptor metacyclophanes 1-4 as well as 24 were synthesized via the correspondingly substituted 2,11-dithiametacyclophanes 8, 13, and 25 and their disulfone derivatives.The anti-compound 1 and the syn-isomer 2 were isolated and characterized.The attempt of the analogous synthesis of 5/6 via 21 and 22 failed since with loss of the intraanular substituents and by transanular C-C formation the tetrahydropyrene derivative 23 was formed.For spectroscopic comparison 27 was prepared via 28.- X-Ray structure analyses of 21, 24, and 25 were performed.The molecular structures of these compounds are discussed under the aspects of sterical strain and donor-acceptor overlap.The structure analyses confirm the assignment to the syn- and anti-series as derived from 1H NMR.- Absorption spectra of 1, 2, 3, and 24 were measured; especially the surprising absorption behaviour of the isomers 1 and 2 with very different donor-acceptor overlap was of interest.Determination of the solvent dependence of fluorescence made sure that the absorptions dealt with are indeed charge-transfer transitions.