Aplicação do dióxido de titânio como fotocatalisador na degradação do diuron: avaliação das variáveis operacionais e estudo mecanístico / Application of titanium dioxide as photocatalyst in diuron degradation: operational variables evaluation and mechanistic study

RESUMO O diuron (DI) é um herbicida utilizado em culturas agrícolas para o controle de ervas daninhas que podem causar desde irritações na pele até problemas cancerígenos. Neste estudo, a fotocatálise heterogênea foi utilizada para a degradação do DI aplicando o dióxido de titânio (TiO2) como catalisador em um reator em batelada. Planejamentos experimentais foram realizados a fim de avaliar a influência do pH, da concentração do catalisador e do substrato, e de maximizar a degradação do DI. Depois de 3 horas de reação, foi possível observar que o pH foi a variável com maior influência na degradação do herbicida utilizando o TiO2 como catalisador. Com o estudo mecanístico foi possível propor que a degradação desse herbicida é realizada pelos radicais hidroxilas gerados da redução do O2. O modelo estatístico realizado neste estudo pode ser aplicado para o aprimoramento do processo de tratamento de efluentes industriais e agrícolas utilizando a fotocatálise heterogênea.

ABSTRACT Diuron (DI) is a herbicide used in agricultural fields for weed control that can cause skin irritations and carcinogenic problems. In this study, heterogeneous photocatalysis was used for the degradation of the DI applying TiO2 as catalysts in a batch reactor. Experimental designs were performed to evaluate the influence of pH, catalyst concentration and substrate, also to maximize DI degradation results. After 3 hours of reaction, it was possible to observe that pH was the variable with the significant influence on the degradation of the DI using TiO2 as a catalyst. With the mechanistic study it was possible to propose that the degradation of this herbicide is carried out by the hydroxyl radicals generated from the O2 reduction. The statistical models performed in this study can be applied to improve the process of treatment of industrial and agricultural effluents using heterogeneous photocatalysis.

Triterpenes from Protium hebetatum resin.

Three olean (beta-amyrenone, beta-amyrin and maniladiol), three ursane (alpha-amyrinone, alpha-amyrin and breine) and four tirucallane (3-oxotirucalla-8,24-dien-21-6ic acid, 3alpha-hydroxytirucalla-8,24-dien-21-oic acid, 3alpha-acetoxytirucalla-8,24-dien-21-oic acid and 3alpha-hydroxytirucalla-7,24-dien-21-oic acid) triterpenes were isolated from the oleoresin of Protium hebetatum Daly. The structures were established mainly by 13C, 1D and 2D NMR spectroscopic analysis. The isolation of 3alpha-hydroxytirucalla-8,24-dien-21-oic acid permitted correction of the chemical shift assignments of some of its carbon atoms.

Larvicidal and nematicidal activities of the leaf essential oil of Croton regelianus.

The chemical composition of the leaf essential oil of Croton regelianus collected from wild plants growing in two different sites at Ceará State (Brazil) was analyzed by GC/MS and GC-FID. Twenty monoterpenoids, representing more than 96% of the chemical composition of the oils, were identified and quantified. The oils showed similar chemical composition but considerable variation in the levels of each constituent. Ascaridole (33.9-17.0%), p-cymene (22.3-21.6%), and camphor (13.0-3.1%) were the predominant constituents. The monoterpene ascaridole was isolated and characterized by spectroscopic data. The essential oils and the isolated compounds were tested against Aedes aegypti and Artemia sp. larvae, and the root knot nematode Meloidogyne incognita. The bioassay results show that the essential oil of C. regelianus and ascaridole were moderately active against the M. incognita, but strongly effective against both A. aegypti and Artemia sp. larvae.

Cucurbitacins from Cayaponia racemosa: isolation and total assignment of 1H and 13C NMR spectra.

Two new cucurbitane-type triterpenoids, 2beta,3beta,16alpha,20(R),25-pentahydroxy-9-methyl-19-norlanost-5-en-7,22-dione and 2beta,3beta,16alpha,20(R),25-pentahydroxy-9-methyl-19-norlanost-5-en-7,11,22-trione, were isolated from fruits of Cayaponia racemosa. The total (1)H and (13)C chemical shift assignment of these two closely related compounds is described, making use of one- and two-dimensional NMR techniques.

Total assignments of 1H and 13C NMR spectra of isocatalpanol and a derivative of tecomaquinone.

Isocatalpanol and tecomaquinone I were obtained from roots of Lippia sidoides, a medicinal plant from northeast Brazil. Reduction of tecomaquinone I with NaBH4 yielded a new derivative. Structural elucidation was done on the basis of spectral data, mainly by high-field NMR and electron ionization mass spectrometry.

Constituintes químicos de Lippia sidoides (Cham. ) Verbenaceae

Thirteen compounds, 3-O-acetyloleanolic acid (1), methyl 3,4-dihydroxy benzoate (2), lapachenol (3), tecomaquinone (4), tectoquinone (5), tectol (6), acetilated tectol (7), quercetin (8), luteolin (9), glucoluteolin (10), lippisidoquinone (11), taxifolin (12) and isolariciresinol (13), were isolated from ethanol extract of Lippia sidoides. Their structures were assigned unambiguously by a combination of 1D and 2D NMR, IR and EIMS spectral data analysis and comparison with the published data for structurally related compounds. In brazilian traditional medicine the aerial parts of this specie are used as anti-infective agent, particularly as antiseptic.