Sharif Digital Repository

Aromatic aldehydes and ketones are readily acetalized or ketalized under microwave irradiation in the presence of water as a solvent  

Rate constants, k A, for the aromatic nucleophilic substitution reaction of 2-chloro-3,5-dinitropyridine with aniline were determined in different compositions of 2-propanol mixed with hexane, benzene, and 2-methylpropan-2-ol and 1-ethyl-3-methylimidazolium ethylsulfate ([Emim][EtSO4]) with dimethyl sulfoxide at 25 C. The obtained rate constants of the reaction in pure solvents are in the following order: 2-methylpropan-2-ol > dimethyl sulfoxide > 2-propanol > hexane > benzene > [Emim][EtSO4]. Molecularmicroscopic solvent parameters corresponding to the selected binary mixtures were utilized to study the kinetics of a nucleophilic substitution reaction in order to investigate and compare the... 

In this paper sustainability analysis (exergy, environmental and economic) and multi-objective optimization for an aromatic plant are provided and interactions between decision variables are discussed. Environmental evaluation shows that the cancer human toxicity and global warming are the most important environmental concerns and the weight of EIs (environmental impacts) are mainly due to process wastes. The optimizations results demonstrate parameters like reactor temperature have a wide range in the optimizations while some variables, such as extraction unit variables have the same value. Utility EI reduction occurred in economic and exergy optimizations rather than environmental... 

Thiomorpholine 1,1-dioxides were prepared with double Michael addition reaction of aromatic amines to divinyl sulfone catalyzed by boric acid/glycerol in water. This catalyst system was also used for the Michael addition reaction of aromatic amines to electron-deficient alkenes. The reaction is simple and green and gives good to excellent yields  

A new di-manganese complex with "back-to-back" 1,4-bis(2,2′:6,2′′-terpyridin-4′-yl) benzene ligation has been synthesized and characterised by a variety of techniques. The back-to-back ligation presents a novel new mononuclear manganese catalytic centre that functions as a heterogeneous catalysis for the evolution of oxygen in the presence of an exogenous oxidant. We discuss the synthesis and spectroscopic characterizations of this complex and propose a mechanism for oxygen evolution activity of the compound in the presence of oxone. The di-manganese complex also shows efficient and selective catalytic oxidation of sulfides in the presence of H2O2. Density functional theory calculations were... 

Dissolved air precipitation/solvent sublation (DAP/SS) was used for treatment of simulated and real oilfield produced water to generate very fine bubbles which are necessary for effective separation. In this method micro bubbles produced by saturation of air in a pressurized packed column were released in an atmospheric column leading the bubbles to raise resulting trapped contaminants in the Gibbs layer around them to be removed by a layer of immiscible solvent at the top of column. The method was conducted to solutions including Benzene, Toluene and Chlorobenzene (ClB) as part of BTEX contaminants in produced water, mixture of them as simulated produced water and real oilfield produced... 

(Liquid + liquid) equilibrium (LLE) data for the ternary systems (heptane + toluene + 1-ethyl-3-methylpyridinium ethylsulfate) and (heptane + benzene + 1-ethyl-3-methylpyridinium ethylsulfate) were measured at T = 298.15 K and atmospheric pressure. The selectivity and aromatic distribution coefficients, calculated from the equilibrium data, were used to determine if this ionic liquid can be used as a potential extracting solvent for the separation of aromatic compounds from heptane. The consistency of tie-line data was ascertained by applying the Othmer-Tobias and Hand equations  

Petroleum monoaromatics including benzene, toluene, ethylbenzene, and xylenes (BTEX) are among the notorious volatile organic compounds that contaminate water and soil. In this study, a surfactant- modified natural zeolite and its relevant granulated nanozeolites were evaluated as potential adsorbents for removal of petroleum monoaromatics from aqueous solutions. All experiments performed in batch mode at constant temperature of 20°C and pH of 6.8 for 48 h. The results revealed that the amount of BTEX uptake on granulated zeolites nanoparticles were remarkably higher than the parent micron size natural zeolite (in the order of four times). The isotherms data were analyzed using five models... 

Some new 1,4-distyrylbenzene derivatives were synthesized by using immobilized palladium nanoparticles on silica-bonded N-propyl morpholine (PNP-SBNPM) as a heterogeneous catalyst. These one-pot reactions afforded a range of stereoselective, symmetrical (E)-1,4-distyrylbenzene derivatives with high yields (78-90%). The green catalyst system is recyclable and allows facile product isolation. The recycled catalyst could be reused six times without appreciable loss of catalytic activity  

In this paper, an industrial ethylbenzene production unit has been simulated and the results are compared against five-day experimental data. According to prevailing unit condition, i.e. recycled ratio of benzene, benzene selectivity, and energy consumption, the unit is not working under its optimum conditions for minimum cost of ethylbenzene production. In the current design, high amount of benzene recycle (6:1) causes to have an additional cost due to fractionation of ethylbenzene from benzene. A new approach is proposed to modify the benzene alkylation process and reduce the unit's energy consumption. In the newly designed scheme, two double-bed alkylation reactors converted into four... 

Titanium nitride-carbon nanocomposites are synthesized by the reaction of TiCl4 and NaN3 in supercritical benzene medium that also serves as a carbon source. The as-prepared precursors (SI, SII) are subjected to several heat treatments (SIII-SV). The synthesized nanoparticles are characterized by X-ray photoelectron spectroscopy (XPS), Fourier transform infrared spectroscopy (FTIR), X-ray diffraction (XRD), field emission scanning electron microscopy (FE-SEM), and transmission electron microscopy (TEM). The samples are tested as electrocatalyst for oxygen reduction reaction in an alkaline electrolyte. It is shown that the electrocatalytic properties of the synthesized nanoparticles are... 

In the present work, the roles of inorganic oxide nanoparticles on the extraction efficiency of polyethylene terephthalate-based nanocomposites were extensively studied. Four fiber coatings based on polyethylene terephthalate nanocomposites containing different types of nanoparticles along with a pristine polyethylene terephthalate polymer were conveniently electrospun on stainless steel wires. The applicability of new fiber coatings were examined by headspace-solid phase microextraction of some environmentally important volatile organic compound such as benzene, toluene, ethylbenzene and xylene (BTEX), as model compounds, from aqueous samples. Subsequently, the extracted analytes were... 

The present study was carried out to evaluate the degradation efficiency of benzene, toluene, and xylene (BTX) by isolated bacteria from various petroleum-hydrocarbons contaminated sites. Five isolated bacteria were selected for testing BTX biodegradation from liquid culture media. Each of these bacteria was able to degrade BTX but with different efficiencies. Maximum biodegradation efficiency for benzene (more than 70 %) was obtained by Gram-positive coccobacillus, Gram-positive coccus and Gram-negative bacillus bacteria, for toluene (60 %) and xylene (70 %) by Gram-positive coccobacillus and Gram-negative coccobacillus. It was found that the presence of xylene in the substrate mixture... 

Silica aerogel-multi wall carbon nanotube composites were synthesized successfully with a waterglass precursor and an ambient pressure drying method. Pure silica aerogels are so fragile that they cannot be used easily. Carbon nanotubes (MWCNT) were used as reinforcements to strengthen the mechanical properties of pure silica aerogels. Results show that inserting small amounts of MWCNT causes silica aerogels to monolith. By addition of MWCNT, monolith nanocomposites were produced with 800 m2/g surface area and a 140° contact angle. Results show that the silica aerogels and reinforced composites have an excellent adsorption property for the removal of organic pollutants from water. The average... 

In this paper, the effects of a baffle plate on flame deflection and its throttling are investigated numerically in a combustor consuming jet propellant JP. We study the plate effects on the resulting soot volume fraction, soot particles diameter, mass fractions of carbon monoxide (CO), carbon dioxide (CO2), and benzene (C6H6). We use a two-equation turbulence model, a PAH-inception two-equation soot model imposing oxidation due to OH agents, a detailed chemical kinetic consisting of 121 species and 2613 elementary reactions, and the flamelet combustion model to perform the current study. We also take into account the turbulence-chemistry interaction using the presumed-shape probability...