Application of some physical organic chemistry models to the study of oil spills residues in Patagonian soils

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The present study focuses on the application of some physical organic chemistry (POC) models for a better understanding of the interactions between oil spills and soil. By studying the sorption behavior of pure compounds, it was possible to examine the application of the multilayer model to the pred...

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Detalles Bibliográficos
Autor principal: Nudelman, N.S
Otros Autores: Ríos, S.M, Katusich, O.
Formato: Capítulo de libro
Lenguaje:Inglés
Publicado: 2008
Acceso en línea:Registro en Scopus
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Biblioteca Central Dr. Luis F. Leloir (FCEN) de Universidad de Buenos Aires
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100 1 |a Nudelman, N.S. 
245 1 0 |a Application of some physical organic chemistry models to the study of oil spills residues in Patagonian soils 
260 |c 2008 
270 1 0 |m Nudelman, N. S.; Department of Organic Chemistry, Facultad de Ciencias Exactas y Naturales, Universidad de Buenos Aires, Pab. II, P. 3, Ciudad Universitaria, 1428 Buenos Aires, Argentina; email: nudelman@qo.fcen.uba.ar 
506 |2 openaire  |e Política editorial 
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520 3 |a The present study focuses on the application of some physical organic chemistry (POC) models for a better understanding of the interactions between oil spills and soil. By studying the sorption behavior of pure compounds, it was possible to examine the application of the multilayer model to the prediction of crude oil isotherms. The difference between the predicted and experimental oil isotherms was only 13%, which indicates the reliability of the model. The distribution coefficients, Kd of soil samples containing oil residuals of different ages, were also determined using methanol as a co-solvent. Desorption experiments showed that they are a function of the polarity of the liquid phases; the Kds, calculated by applying a model derived from the solvophobic theory, increase with increasing age. On the other hand, the natural attenuation of oil spills was studied by using GC and 1H NMR techniques. Signals for four types of aliphatic and for the aromatic protons were clearly assigned; signals for alcohol (OH) and carboxylic (COOH) protons were also observed; compounds exhibiting these polar groups are usually not detected in the GC-FID conventional analysis. The principal component analysis (PCA) of Kd and the parameters determined by GC and NMR, showed that the first and second PC, accounted for more than 95 and 81% of variance, for NMR and GC parameters, respectively. The detailed results suggest that the 1H NMR data would be more useful than GCs to evaluate the environmental transformations that oil spills undergo in Patagonian soils. Nevertheless, direct extrapolation of the present results to other environments is not possible because the changes depend strongly on the original chemical composition of the crude oil and the variable exposure conditions along the time. Copyright © 2008 John Wiley & Sons, Ltd.  |l eng 
593 |a Department of Organic Chemistry, Facultad de Ciencias Exactas y Naturales, Universidad de Buenos Aires, Pab. II, P. 3, Ciudad Universitaria, 1428 Buenos Aires, Argentina 
593 |a Department of Chemistry, Facultad de Ciencias Naturales, Universidad Nacional de la Patagonia San Juan Bosco, Km 4, 9000 Comodoro Rivadavia, Chubut, Argentina 
690 1 0 |a BET MODEL 
690 1 0 |a CRUDE OIL SORPTION 
690 1 0 |a DISTRIBUTION COEFFICIENTS 
690 1 0 |a OIL NMR PARAMETERS 
690 1 0 |a OIL RESIDUES 
690 1 0 |a OIL SPILL 
690 1 0 |a PCA 
690 1 0 |a CRUDE PETROLEUM 
690 1 0 |a ISOTHERMS 
690 1 0 |a METHANOL 
690 1 0 |a NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY 
690 1 0 |a PRINCIPAL COMPONENT ANALYSIS 
690 1 0 |a SOILS 
690 1 0 |a SORPTION 
690 1 0 |a BET MODEL 
690 1 0 |a DISTRIBUTION COEFFICIENTS 
690 1 0 |a OIL RESIDUES 
690 1 0 |a PHYSICAL ORGANIC CHEMISTRY (POC) MODELS 
690 1 0 |a OIL SPILLS 
700 1 |a Ríos, S.M. 
700 1 |a Katusich, O. 
773 0 |d 2008  |g v. 21  |h pp. 329-337  |k n. 4  |p J Phys Org Chem  |x 08943230  |w (AR-BaUEN)CENRE-576  |t Journal of Physical Organic Chemistry 
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856 4 0 |u https://doi.org/10.1002/poc.1335  |y DOI 
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