Sharif Digital Repository

The liquid-phase dehydration of 1,4-butanediol to tetrahydrofuran was investigated over various materials including synthetic zeolites, namely, ZSM-5, Y, Mordenite, Ferrierite, and Beta as well as silica and alumina. The key characters investigated were the Si/Al ratio and cation exchange. The results showed that the ZSM-5 zeolite exchanged with NH4+ exhibited the highest activity in dehydration of 1,4-butanediol. In all tests, nearly 100% selectivity to tetrahydrofuran was observed. After finding the most active catalyst, the kinetics of dehydration of 1,4-butanediol to tetrahydrofuran was studied over this material. The influence of operating parameters such as temperature, pressure, and... 

In the present work, Tetrahydrofuran was produced from 1,4-butanediol by catalytically dehydration of 1,4-butanediol in contact with a catalyst. Material used as catalyst were Synthesized and natural zeolites as well as alumina and silica. Synthesized zeolites were investigated in different aspect such as pore size, cation and Si/Al ratio. Results indicated that with increasing the Si/Al ratio, the activity of the zeolite used for 1, 4-butanediol dehydration step was reduced. Furthermore, it was observed that, upon the replacement of sodium with hydrogen and ammonium cations, the conversion of the 1, 4-butanediol into tetrahydrofuran was increased. It was shown zeolites possessing smaller... 

A series of bifunctional Cu-ZnO-ZrO2/H-Y catalysts of different compositions were prepared by coprecipitating sedimentation method and were characterized by surface area and XRD analyses. The catalytic performance in synthesis of tetrahydrofuran was evaluated and optimized in a three-phase slurry batch reactor. The experimental results showed that the appropriate ratio of Cu/ZnO in the hydrogenation catalyst was 50/45, for which the conversion of maleic anhydride (MA) and selectivity of tetrahydrofuran (THF) reached 100% and 46%, respectively, at 50 bar and 493 K after 6 h of operation. Also, according to these results, it was demonstrated that the incorporation of zirconium oxide in the... 

Ab initio quantum mechanics and ONIOM calculations were used to study solvent and substituent effects on the reactions of 1,4-benzoquinone with cyclopentadiene and cyclohexadiene derivatives in tetrahydrofuran and greater water solvents. These calculations revealed (i) that increasing the number of electron donating methyl group substituents and (ii) the proximity of substituents to the reacting carbons (carbon atoms which contribute to the forming C-C bonds) on the diene, promote charge transfer from the diene to the dienophile in the transition state. © 2008 Science Reviews 2000 Ltd. These effects increase the negative charge on the oxygen atoms, destabilize the transition state in the... 

Hydroxyapatite (HA) is the most substantial mineral constituent of a bone which has been extensively used in medicine as implantable materials, owing to its good biocompatibility, bioactivity high osteoconductive, and/or osteoinductive properties. Nevertheless, its mechanical property is not utmost appropriate for a bone substitution. Therefore, a composite consist of HA and a biodegradable polymer is usually prepared to generate an apt bone scaffold. In the present work polycaprolactone (PCL), a newly remarkable biocompatible and biodegradable polymer, was employed as a matrix and hydroxyapatite nanoparticles were used as a reinforcement element of the composite. HA/PCL nanocomposites were...