Development and application of SBA‐15 assisted electromembrane extraction followed by corona discharge ion mobility spectrometry for the determination of Thiabendazole in fruit juice samples

A new sample preparation method based on SBA‐15 assisted electromembrane extraction coupled with corona discharge ion mobility spectrometer was developed for the determination of Thiabendazole as a model basic pesticide in fruit juice samples. The addition of SBA‐15 in the supported liquid membrane in electromembrane extraction system not only can lead to enhancement of the effective surface area, but also introducing the negatively charged silanol groups into supported liquid membrane might improve migration of positively charged analytes toward the supported liquid membrane and finally into the acceptor solution. To investigate the effect of the presence of SBA‐15 in the supported liquid membrane on the extraction efficiency, a comparative study was carried out between the conventional electromembrane extraction and SBA‐15/electromembrane extraction methods. Under the optimized conditions, SBA‐15/electromembrane extraction method showed higher extraction efficiencies in comparison with conventional electromembrane extraction method. SBA‐15/electromembrane extraction method exhibited a low limit of detection (0.9 ng/mL), high preconcentration factor (167) and high recovery (83%). Finally, the applicability of SBA‐15/electromembrane extraction method was studied by the extraction and determination of Thiabendazole as a model basic pesticide in fruit juice samples.     

Synthesis,characterization, cytotoxicity,DNA binding and computational studies of an anionic palladium(II) complex derived from 8-hydroxyquinoline and 1,1-cyclobutanedicarboxylate

A novel 1,1-cyclobutanedicarboxylato-8-hydroxyquinolinatopalladate(II), Na[Pd(8-QO)(cbdca)] (8-QO = 8-hydroxyquinoline and cbdca = 1,1-cyclobutanedicarboxylate) has been designed and synthesized. The structure of the complex has been characterized by elemental analysis, molar conductance, FT-IR, UV–Vis, ¹³C NMR, ¹H NMR spectroscopy. The cytotoxic activities of the complex have been tested against human foreskin fibroblast normal cell line, HFFF2 and two human breast cancer cell lines, T47D and MCF-7 by MTT assay techniques. The binding properties of the antitumor complex with calf thymus DNA (ctDNA) have been investigated under physiological condition in Tris–HCl buffer solution at pH 7.0 by absorption spectroscopy, fluorescence titration spectra, EB displacement and gel chromatography studies. All these results demonstrate that the water soluble complex can cooperatively bind to ctDNA at low concentrations through a static quenching procedure. Thermodynamic parameters were calculated according to Van’t Hoff equation which indicated that hydrogen bond and van der Waals force play predominant roles in the binding process. Finally, the results of molecular docking calculations clarify the binding mode which is in good accordance with experimental results.     

KAl(SO4)2 · 12H2O (alum) a reusable catalyst for the synthesis of some 4-substituted coumarins via Pechmann reaction under solvent-free conditions

A simple, efficient, and practical procedure for the Pechmann condensation using KAl(SO₄)₂ · 12H₂O (alum) as a non-toxic, reusable, inexpensive, and easily available catalyst is described under solvent-free condition at 65°C. These improved reaction conditions allow the preparation of a wide variety of some new substituted coumarins in high yields (86–96%) and purity under mild reaction conditions. Compared to the classical Pechmann condensation, this new method consistently has the advantage of high yields. Correspondence: Ali A. Mohammadi, Department of Chemistry, Shahid Beheshti University, P.O. Box 19839-4716, Tehran, Iran.     

Efficient synthesis of N,N′-dialkyl-N″-dialkylaminocarbothioyl thioureas from cyclic secondary amines, CS2, and N,N′-dialkyl carbodiimides in water

A mild, convenient, and practical one-pot procedure for direct synthesis of N,N′-dialkyl-N″-dialkylaminocarbothioyl thioureas is described via three-component reaction of cyclic secondary amines, CS₂, and N,N′-dialkyl carbodiimides in water at room temperature.     

A greedy meshless local Petrov–Galerkin methodbased on radial basis functions

The meshless local Petrov–Galerkin (MLPG) method with global radial basis functions (RBF) as trial approximation leads to a full final linear system and a large condition number. This makes MLPG less efficient when the number of data points is increased. We can overcome this drawback if we avoid using more points from the data site than absolutely necessary. In this article, we equip the MLPG method with the greedy sparse approximation technique of (Schaback, Numercail Algorithms 67 (2014), 531–547) and use it for numerical solution of partial differential equations. This scheme uses as few neighbor nodal values as possible and allows to control the consistency error by explicit calculation. Whatever the given RBF is, the final system is sparse and the algorithm is well‐conditioned. © 2015 Wiley Periodicals, Inc. Numer Methods Partial Differential Eq 32: 847–861, 2016     

Density and viscosity of 1-butyl-3-methylimidazolium nitrate with ethanol, 1-propanol, or 1-butanol at several temperatures

Densities and viscosities of 1-butyl-3-methylimidazolium nitrate [Bmim][NO₃], and its binaries with alcohol (ethanol, 1-propanol, or 1-butanol) were measured at different temperatures. The densities and viscosities of pure ionic liquid were correlated successfully by empirical equations. The Vogel–Fulcher–Tammann equations can fit the experimental data of viscosities for pure IL. Excess molar volume and viscosity deviations were calculated for the binaries. The excess molar volumes have negative deviations from the ideal solution.     

Imbibition of Anionic Surfactant Solution into Oil-Wet Capillary Tubes

The displacement of oil by anionic surfactant solutions in oil-wet horizontal capillary tubes is studied. The position of the oil–water interface is recorded with time. The surfactant solution used is a mixture of several different surfactants and co-solvents tailored to produce ultra-low interfacial tension (IFT) for the specific oil used in the study. The surfactant solution results in ultra-low IFT at optimum salinity and room temperature. Several experimental parameters including the capillary tube radius and surfactant solution viscosity are varied to study their effect on the interface speed. Two different models are used to predict the oil–water interface position with time. In the first model, it is assumed that the IFT is constant and ultra-low throughout the experiments. The second model involves change of wettability and IFT by adsorption of surfactant molecules to the oil–water interface and the solid surface. Comparing the predictions to the experimental results, it is observed that the second model provides a better match, especially for smaller capillary tubes. The model is then used to predict the imbibition rate for very small capillary tubes, which have equivalent permeability close to oil reservoirs. The results show that the oil displacement rate is limited by the rate of diffusion of surfactants to the interface.     

Fractional Flow Approach to Saturation Overshoot

Saturation overshoot is observed for 1D vertical infiltrations (liquid replacing gas) in many porous media. Aspects of these infiltrations are often described using the Richards equation, which assumes that the gas viscosity is negligible compared to the liquid viscosity. Here, we develop a multi-phase, fractional flow approach to describe the physics behind the displacement front that includes the viscosity of the gas. We show that an overshoot profile will draw in gas behind the overshoot tip. We compare the fractional flow solution to the Richards equation solution and to experimental data, and show that the air viscosity plays an observable role when the infiltrating flux is greater than 50% of the saturated conductivity.     

Hydrothermally grown nano-manganese oxide on clinoptilolite for low-temperature propane-selective catalytic reduction of NO<Subscript>x</Subscript>

A novel nano-size Mn_xO_y/clinoptilolite catalyst of high activity for propane-SCR reaction of NO_x at low temperatures has been synthesized by a hydrothermal method in a temperature range of 80–180 °C. The optimum synthesis temperature resulting in maximum NO_x conversion was 150 °C. An optimum manganese oxide loading of 0.2 wt.% results in the best catalytic behavior (71% NO_x conversion). All catalysts exhibited an optimal propane-SCR reaction temperature of 200 °C. The optimum catalyst produces no detectable CO (GHSV 27,000 h) at 200 °C. Manganese in the optimum catalyst exists as Mn²⁺ (37.8%), Mn³⁺ (14.2%), and Mn⁴⁺ (48%).

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Graphical abstract Flake-like manganese oxide nanostructures (indicated by an arrow in the TEM picture) next to the clinoptilolite zeolite sheet-like crystals result in a promising low-temperature propane-selective catalytic reduction of NO_x.