1,069 research outputs found

    High conversion of palm olein to ethyl esters using a strong anion exchange resin: study of the operational parameters

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    Biodiesel, known as a mixture of fatty acid ethyl/methyl esters, is seen as an alternative, ecofriendly, biodegradable and renewable non-fossil fuel. The use of heterogeneous catalysts for biodiesel synthesis can solve several problems associated with the homogeneous alkaline catalyzed-transesterification. Therefore, this work reports the evaluation of the commercial resin Amberlyst A26OH, a strong anion exchange resin, as a heterogeneous catalyst for the batch transesterification of refined palm olein with ethanol. It was studied the effects of the main operational parameters, considering the molar ratio of the reaction mixture (MRRM), namely the molar ratio of ethanol to olein taking into account only the ethanol added to the reaction system, and the total molar ratio (TMR), in this case considering also the amount of ethanol carried by the resin after its pretreatment. It was determined an optimal range of operational conditions by response surface methodology, guaranteeing conversion to ethyl esters higher than 96% with a catalyst amount corresponding to a range from 10.4 to 11.4% of the oil quantity, a temperature within the range of 55 to 60 ºC and a MRRM within the range from 3.5:1 to 6.0:131714011412CONSELHO NACIONAL DE DESENVOLVIMENTO CIENTÍFICO E TECNOLÓGICO - CNPQCOORDENAÇÃO DE APERFEIÇOAMENTO DE PESSOAL DE NÍVEL SUPERIOR - CAPESFUNDAÇÃO DE AMPARO À PESQUISA DO ESTADO DE SÃO PAULO - FAPESP406963/2016-9; 406856/2013-3; 429873/2018-2; 305870/2014-9Sem informação2014/21252-0; 2016/10636-

    Thermoresponsive Hydrogel Containing Viscum album Extract for Topic and Transdermal Use: Development, Stability and Cytotoxicity Activity

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    Viscum album L. (Santalaceae), also known as European mistletoe, is a semi-parasitic plant that grows on different host trees. Our group recently demonstrated the antitumoral activity of ethanolic V. album extracts in vitro, depending on the dose and the host tree, V. album ssp abietis from Abies alba being the most active extract. The goal of this work focused on the development of a new topical formulation containing V. album extracts, evaluation of in vitro toxicity and ex vivo skin permeation assays. The Poloxamer 407 hydrogel containing 5% of dry (VA_DEH) or aqueous (VA_AEH) extract presented dermal compatible pH and microbiological stability for 180 days. The hydrogels flow curve presented a non-linear relation, characteristic of non-Newtonian fluids, and the mean viscosity for the VA_DEH and VA_AEH was 372.5 ± 7.78 and 331.0 ± 2.83 Pa.s, respectively, being statistically different (Welch’s t test; p < 0.01). Additionally, WST-1 in vitro assays revealed a dose-dependent toxicity for both formulations and VA_DEH presented a higher activity than the VA_AEH. The promising cytotoxic potential of VA_DEH lead to the ex vivo skin permeation assay with 2.73 ± 0.19 µg/cm(2) of chlorogenic acid, which permeated at 8 h, showing a transdermal potential. These in vitro results support the idea that VA_DEH is a novel promising candidate for mistletoe therapy. Therefore, further in vivo and pre-clinical experiments should be performed to evaluate the safety and efficacy of this new dermic delivery system

    Experimental and theoretical study of the kinetics of dissociation in cis-[Ru'Cl IND.2'(P-P)(N-N)] type complexes

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    As reações de substituição [RuCl2(P-P)(N-N)] + L → [RuCl(L)(P-P)(N-N)]+ + Cl-, onde P‑P = 1,4-bis(difenilfosfino)butano e N-N = 2,2´-bipiridina, 4,4´-dimetóxi-2,2´-bipiridina, 4,4´-dimetil-2,2´-bipiridina e 4,4´-dicloro-2,2´-bipiridina, L = piridina (py) ou 4-metilpiridina (4-pic), foram estudadas sob condições de pseudo-primeira ordem. As reações ocorrem por um mecanismo dissociativo e as constantes de velocidade nas reações de substituição aumentam com o aumento do pKa dos ligantes N-heterocíclicos e com a diminuição dos potenciais de oxidação do centro metálico. Quanto mais alta é a porcentagem de participação dos orbitais atômicos d do metal na formação do HOMO, conforme calculado pelo método DFT, mais fácil é a dissociação do cloreto da esfera de coordenação do complexo. Nos espectros de 31P{1H} RMN da série de complexos de fórmula geral [RuCl(L)(P-P)(N-N)]PF6, há dois dubletos com Δσ < 1, o que é consistente com produtos formados pela dissociação do cloreto trans ao átomo de fósforo nos precursores.The substitution reactions [RuCl2(P-P)(N-N)] + L → [RuCl(L)(P-P)(N-N)]+ + Cl-, where P‑P = 1,4-bis(diphenylphosphino)butane and N-N = 2,2´-bipyridine, 4,4´-dimethoxy-2,2´-bipyridine, 4,4´-dimethylpyridine-2,2´-bipyridine and 4,4´-dichloro-2,2´-bipyridine, L = pyridine (py) or 4-methylpyridine (4-pic), were studied under pseudo-first order conditions. The reactions proceeded by means of a dissociative mechanism. The rate constants of the substitution reactions increased as the pKa of the N-heterocyclic ligands increased and as the oxidation potential of the metal center decreased. The greater the participation of the atomic d orbitals of the metal in the HOMO, according to DFT calculations, the easier is the dissociation of the chloride from the coordination sphere of the complex. In the 31P{1H} NMR spectra of the series of complexes of general formula [RuCl(L)(P-P)(N-N)]PF6, there are two doublets with Δσ < 1. This is consistent with products formed by dissociation of the chloride trans to one of the phosphorus atoms in the precursors.CNPqFAPESPFAPERJCAPE

    Asymmetric heterobimetallic mixed-valence complex trans-[(S'O IND.3')Co(cyclam)(NCS)Ru'(N'H IND.3') IND.4'(NCS)](B'F IND.4'): synthesis and characterization

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    [(SO3)Co(cyclam)(NCS)] and [(SO3)Co(cyclam)-NCS-Ru(NH3)4(NCS)](BF4) complexes were synthesized and characterized by means of X-ray diffraction, electrochemistry, elemental analysis, and spectroscopic techniques. Crystallographic and FTIR data indicated NCS- ligand is coordinated to Co through the nitrogen atom in the monomer species. Electrochemistry and FTIR data of the material isolated after reductive electrolysis of [(SO3)Co(cyclam)(NCS)] hint that NCS- and SO32- are released thus forming [Co(cyclam)(L)2]2+, where L is solvent molecules. The formation of the heterobimetallic mixed-valence complex induced a thermodynamic stabilization of Co and Ru metal atoms in the oxidized and reduced states, respectively. According to the Robin and Day classification, a Class II system with a comproportionation constant of 5.78 × 106 is suggested for the mixed-valence complex based on the electrochemical and UV-Vis-NIR results.CNPq (303530/2008-1)CAPESFAPESPFUNCA
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