Sharif Digital Repository

In this paper, the performance of the benzene gas detection sensor in the air is optimized by an experimental design method. So in this work, Nanostructured thin films of ZnO and Zn2SnO4 were prepared in wurtzite form via a facile atmospheric pressure chemical vapor deposition (CVD) method, using metallic zinc and tin precursors. Characterization of the gas sensor was performed by using Powder X-ray diffraction (PXRD), scanning electron microscopy (SEM) and surface area analysis (using BET method). The results show that Zn2SnO4 nanowire network exhibited good sensitivity at 299 °C temperature to low concentrations (100 ppb) of Benzene which can be potentially used as a resistive gas sensor.... 

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

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... 

The effect of one of the surfactants such as Tiron, a compound based on the benzene molecule, on the morphology and chemical composition of zinc oxide deposits, produced from a zinc complex solution using two-stage chemical deposition (TSCD) technique, has been investigated. TSCD technique is a novel and simple chemical route for the deposition of ZnO film from aqueous solution. Zinc oxide films deposited on high purity alumina (HPA) as a substrate. The results show that the addition of Tiron changes the surface morphology and causes to form the fine-grained structure. With a dense and nodular-shape appearance, the film produced from the precursor of zinc complex-containing Tiron, is... 

In the light of the novel physical-chemical properties of supercritical water as a green reaction medium, we studied the synthesis of deuterated benzene in supercritical heavy water, in the presence of sodium deutroxide, as a catalyst. The effects of operational parameters including temperature, time, pressure (density), catalyst amount and benzene/D2O volumetric ratio on the degree of deuteriation (D%) and deuterated benzene yield were investigated extensively and the conditions for the highest degree of deuteration and product yield, were optimized. Furthermore, because of the importance of the pressure of solution inside the reaction medium on the H/D exchange process as well as the... 

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... 

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... 

(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  

Land use regression (LUR) has not been applied thus far to ambient alkylbenzenes in highly polluted megacities. We advanced LUR models for benzene, toluene, ethylbenzene, p-xylene, m-xylene, o-xylene (BTEX), and total BTEX using measurement based estimates of annual means at 179 sites in Tehran megacity, Iran. Overall, 520 predictors were evaluated, such as The Weather Research and Forecasting Model meteorology predictions, emission inventory, and several new others. The final models with R2 values ranging from 0.64 for p-xylene to 0.70 for benzene were mainly driven by traffic-related variables but the proximity to sewage treatment plants was present in all models indicating a major local... 

The absolute free energy of solvation of benzene and perfluorobenzene was measured in supercritical carbon dioxide using the expanded-ensemble method in the context of Monte Carlo (MC) Simulations. The MC calculations were carried out at 12 state points on the solvent phase diagram: (ρr = 0.5, 1.0, 1.5, 2.0; Tr = 1.01, 1.10, and 1.20). These conditions were chosen to address the accurance of specific molecular interactions between CO2 and fluorine. The greater stability of perfluorobenzene observed over all states investigated in this study attributed to the greater solvent accessible surface area and 25-30% increase in the strength of the interaction of this molecule with CO2 in the... 

Alkoxides are the most common precursors used for the production of alumina nanopowders. These materials are, however, expensive and corrosive. This paper introduces a new method for the production of alumina nanopowders by rapid cooling of a synthetic caustic sodium aluminate solution (Bayer liquor), followed by calcination in the presence of a surface-stabilizing agent like 1,2-dihydroxy-3,5-benzene disulfonic acid disodium salt (Tiron). The powders produced are characterized by differential thermal analysis, XRD, transmission electron microscopy, scanning electron microscope, and Brunauer-Emmet-Teller. A nanopowder of α-alumina with an average crystallite size of 27.7 nm and an average... 

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... 

In the present study, the effect of two different kinds of surfactants namely conventional (Sodium dodecyl benzene sulfonate (SDBS)) and ionic liquid (IL)-based surfactants are investigated on the tertiary oil recovery using relative permeability concept. In this way, besides the Amott wettability index measurement, unsteady state core flooding tests are performed to not only find the effect of surfactant injection on tertiary oil recovery, but also to investigate their effects on relative permeability of carbonate rocks. In addition, for more reliable conclusions regarding the possible mechanisms, interfacial tension (IFT), compatibility and emulsification tests are carried out as a... 

In this study, a fixed-bed catalytic membrane reactor was used for the production of ethylene and cyclohexane from ethane and benzene. A two-dimensional non-isothermal mathematical model was used for estimating the performance of the membrane reactor. Furthermore, the effect of inlet temperature (720–1080 K), feed molar ratio (3–10) and the reactor spacetime (1–76 kgCat.s/mol) was studied on the conversion of ethane to ethylene and benzene to cyclohexane. The results of modeling showed that with the increase of inlet temperature the conversion of both (de)-hydrogenation reactions increased and the 95% of ethane conversion was achieved when the molar ratio of benzene/ethane was fixed on 3.... 

Superhydrophobic materials have attracted many attentions in recent years while their application in sample preparation remained almost intact. In this project, a rough surface of melamine formaldehyde foam was silanized by chemical deposition of trichloromethylsilane to form a highly porous and superhydrophobic material, presumably a suitable medium for extracting non–polar compounds such as benzene and its methyl derivatives. The prepared sorbent was packed in a needle for the headspace needle–trap microextraction of benzene, toluene, ethylbenzene and xylenes (BTEX). Major parameters associated with the extraction/desorption processes were considered for optimization. Under the optimized... 

The simultaneous oxidation performance of benzene, toluene, ethylbenzene, and xylene (BTEX) by nanoscale calcium peroxide particles (nCaO2) activated with ferric ions (Fe(III)) and the mechanism of the enhancement of BTEX degradation by L-cysteine (L-cys) were investigated. The batch experimental results showed that the nCaO2/Fe(III)/L-cys process was effective in the destruction of BTEX in both ultrapure water and actual groundwater. A proper amount of L-cys could enhance BTEX degradation due to the promotion of Fe(II)/Fe(III) redox cycles by the participation of L-cys, but an excessive presence of L-cys would cause inhibition. Adding 1.0 mM L-cys to the nCaO2/Fe(III) system, the...