Synthesis of fused hydroxy dihydropyrroles and unexpected dihydropyrazine and dihydroquinoxaline derivatives based on heterocyclic ketene aminals

The one-pot four-component synthesis of highly functionalized fused hydroxyl dihydropyrroles and dihydropyrazines from readily available diamines, 1,1-bis (methylsulfanyl)-2-nitroethene, phenylglyoxal monohydrates, and C-H acids have been developed. This strategy provides an efficient, catalyst-free approach for easy access to various new hydroxyl-dihydropyrrole and dihydropyrazine rings in good to high yields. The products were confirmed by ¹H and ¹³C NMR, IR, mass, and X-ray crystal structure analyses.     

Synthesis of amides from imines using Et3SiH/Zn system

A simple and efficient approach for the synthesis of amides by the reaction of imines and acyl chlorides in the presence of Et₃SiH/Zn system in THF at ambient temperature is reported. Mild reaction conditions, good yields of products, short reaction time and operational simplicity are the advantages of this procedure. Copyright © 2012 John Wiley & Sons, Ltd.     

Molecular docking,linear and nonlinear QSAR studies on factor Xa inhibitors

Structural Chemistry - Factor Xa (FXa) enzyme has an important role in the blood coagulation system. Disruption in the enzyme function results in the production of blood clots. Therefore,...     

Corrosion resistance of electroless Cu–P and Cu–P–SiC composite coatings in 3.5% NaCl

The Cu–P and Cu–P–SiC composite coatings on carbon steel substrates were deposited via electroless plating. The anti-corrosion properties of Cu–P and Cu–P–SiC coatings were studied in 3.5% NaCl solution. The anti-corrosion properties of Cu–P and Cu–P–SiC coatings were investigated in 3.5% NaCl solution by the weight loss, potentiodynamic polarisation and electrochemical impedance spectroscopy (EIS) techniques. It has been found that the shift in the corrosion potential (E_corr) towards the noble direction, decrease in the corrosion current density (I_corr), increase in the charge transfer resistance (R_ct) and decrease in the double layer capacitance (C_dl) values indicated an improvement in corrosion resistance with the incorporation of SiC particles in the Cu–P matrix. The effects of varying the SiC concentration on the corrosion resistance of carbon steel were investigated and it was found that the best anti-corrosion property of Cu–P–SiC is at 5 g L^?1 SiC in the bath formulation.     

Sustainable and green microextraction of organophosphorus flame retardants by a novel phosphonium‐based deep eutectic solvent

Based on the solidification of a hydrophobic deep eutectic solvent in air‐assisted liquid phase microextraction combined with gas chromatography and mass spectrometry, a green and sustainable microextraction technique was developed for extracting, separating, and detecting organophosphorus flame retardants in aqueous samples. In this study, some strategies were considered for overcoming or improving the challenges of conventional solvent microextraction procedures. In addition, a hydrophobic deep eutectic solvent with a freezing point near the ambient temperature was employed as an extraction phase, the dispersive solvent was substituted by the syringe pump process, and the centrifugation step was omitted by using salting‐out phenomenon. Further, the effect of the main independent variables was evaluated by using the chemometric methods in order to maximize the extraction efficiency of the procedure. Under optimal conditions, the calibration model was linear in the range of 0.01–25.0 µg/L. Limits of detection and quantitation were assessed at the concentration levels of 2–23 and 9–65 ng/L, respectively. The precision involving repeatability and reproducibility was evaluated by estimating the relative standard deviation, the levels of which were <6.6 and <8.7%, respectively. The applicability of the method was successfully evaluated by analyzing the target analytes in real aqueous samples, which illustrated satisfactory recoveries (95–104.61%).     

Biomimetic electrochemical sensor based on molecularly imprinted polymer for dicloran pesticide determination in biological and environmental samples

Dicloran pesticide is used to inhibit the fungal spore germination for different crops. Because of the increasing application of pesticides, reliable and accurate analytical methods are necessary. The aim of this work is designing the highly selective sensor to determine the dicloran in biological and environmental samples. Multi-walls carbon nanotubes and a molecularly imprinted polymer (MIP) were used as modifiers in the sensor composition. A dicloran MIP and a nonimprinted polymer (NIP) were synthesized and applied in the carbon paste electrode. After the optimization of electrode composition, it was used to determine the concentration of analyte. Parameters affecting the sensor response were optimized, such as sample pH, electrolyte concentration and its pH, and the instrumental parameters of square wave voltammetry. The MIP-CP electrode showed very high recognition ability in comparison with NIP-CP. The obtained linear range was 1 × 10^?6 to 1 × 10^?9 mol L^?1. The detection limit was 4.8 × 10^?10 mol L^?1. This sensor was used to determine the dicloran in real samples (human urine, tap and river water samples) without special sample preparation before analysis. All important parameters were optimized, improving the sensor response considerably.     

Supramolecular-based solvent microextraction of carbaryl in water samples followed by high performance liquid chromatography determination

In this study, a simple, rapid, low cost, sensitive and environmentally friendly technique, supramolecular solvent microextraction (SM-SME) followed by high performance liquid chromatography-ultraviolet has been proposed to extract carbaryl from water samples. Parameters, affecting the SM-SME performance such as the weight of decanoic acid (DeA), volume of tetrahydrofuran (THF), pH and salt concentration, were studied and optimised. The effect of the pH on the extraction efficiency was evaluated by one–factor-at-a-time methodology, but the other variables were optimised by a face-centred cube central composite design methodology. Optimum extraction conditions were obtained: DeA: 70 mg; THF: 650 µL; salt concentration: 10% (w/v) NaCl and pH = 2–4), and the performance of the proposed method was evaluated. Under the optimum conditions, good linearity (1.0–500 µg L^?1, r² = 0.9994) was obtained. Limit of detection and limit of quantification were 0.3–1.0 µg L^?1, respectively. Also, the recoveries of the carbaryl were obtained in the ranged from 96% to 105%. Finally, proposed method was successfully applied for the determination of the carbaryl in the water samples of farms run-off and rivers and satisfactory results were obtained.