Cadmium (Cd) and lead (Pb) concentrations and their relationship to the cocoa content of chocolates commercialized in Brazil were evaluated by graphite furnace atomic absorption spectrometry (GF AAS) after microwave-assisted acid digestion. Several chemical modifiers were tested during method development, and analytical parameters, including the limits of detection and quantification as well as the accuracy and precision of the overall procedure, were assessed. The study examined 30 chocolate samples, and the concentrations of Cd and Pb were in the range of <1.7-107.6 and <21-138.4 ng/g, respectively. The results indicated that dark chocolates have higher concentrations of Cd and Pb than milk and white chocolates. Furthermore, samples with five different cocoa contents (ranging from 34 to 85%) from the same brand were analyzed, and linear correlations between the cocoa content and the concentrations of Cd (R(2) = 0.907) and Pb (R(2) = 0.955) were observed. The results showed that chocolate might be a significant source of Cd and Pb ingestion, particularly for children.

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In this work multivariate experiments were conducted to optimize the operating conditions for inductively coupled plasma optical emission spectrometry (ICP OES) for multielemental determinations in chocolate drink powder. The operating conditions were investigated using a 2(3) central composite design, where the variables studied were radio frequency power, nebulization flow rate, and auxiliary argon flow rate. The effects of these parameters on plasma robustness and on signal to background ratio (SBR) were considered in parallel, allowing the evaluation of robustness and detectability using few and fast experiments to select the best conditions for the determination of the analytes. In this case, the proposed experiments were applied to the optimization of a method aimed at the determination of Al, Ba, Cd, Co, Cr, Cu, Fe, Mg, Mn, Mo, Ni, P, Pb, V, and Zn in chocolate drink powder. The compromise conditions that allowed obtaining a robust and sensitive analytical method were radio frequency power of 1200 W, nebulization flow rate of 0.6 L/min, and auxiliary argon flow rate of 0.3 L/min. Using these conditions, recoveries between 95 and 105% and relative standard deviations lower than 5% were obtained for the majority of the analytes. The proposed method was successfully applied to the analysis of 15 samples of chocolate drink powder. The highest concentrations of metallic species were found in diet and light products.

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Aerosol dilution (AD) is a sample introduction tool that allows the direct analysis of complex matrix samples by plasma-based analytical techniques. In AD, a controlled gas stream (dilution gas) is...

Methylmercury (MeHg+) is a mercury species that is very toxic for humans, and its monitoring and sorption from environmental samples of water are a public health concern. In this work, a combination of theory and experiment was used to rationally synthesize an ion-imprinted polymer (IIP) with the aim of the extraction of MeHg+ from samples of water. Interactions among MeHg+ and possible reaction components in the pre-polymerization stage were studied by computational simulation using density functional theory. Accordingly, 2-mercaptobenzimidazole (MBI) and 2-mercaptobenzothiazole (MBT), acrylic acid (AA) and ethanol were predicted as excellent sulfhydryl ligands, a functional monomer and porogenic solvent, respectively. Characterization studies by scanning electron microscopy (SEM) and Brunauer–Emmett–Teller (BET) revealed the obtention of porous materials with specific surface areas of 11 m2 g−1 (IIP–MBI–AA) and 5.3 m2 g−1 (IIP–MBT–AA). Under optimized conditions, the maximum adsorption capacities were 157 µg g−1 (for IIP–MBI–AA) and 457 µg g−1 (for IIP–MBT–AA). The IIP–MBT–AA was selected for further experiments and application, and the selectivity coefficients were MeHg+/Hg2+ (0.86), MeHg+/Cd2+ (260), MeHg+/Pb2+ (288) and MeHg+/Zn2+ (1510), highlighting the material’s high affinity for MeHg+. The IIP was successfully applied to the sorption of MeHg+ in river and tap water samples at environmentally relevant concentrations.

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