Use of molecular modeling as a tool to evaluate thermodynamic stability of alkylated polycyclic aromatic hydrocarbons

H. Budzinski; P. Garrigues; M. Radke; J. Connan; J. C. Rayez; M. T. Rayez

doi:10.1021/ef00040a011

Use of molecular modeling as a tool to evaluate thermodynamic stability of alkylated polycyclic aromatic hydrocarbons

Energy & Fuels ◽

10.1021/ef00040a011 ◽

1993 ◽

Vol 7 (4) ◽

pp. 505-511 ◽

Cited By ~ 29

Author(s):

H. Budzinski ◽

P. Garrigues ◽

M. Radke ◽

J. Connan ◽

J. C. Rayez ◽

...

Keyword(s):

Polycyclic Aromatic Hydrocarbons ◽

Molecular Modeling ◽

Aromatic Hydrocarbons ◽

Thermodynamic Stability ◽

Polycyclic Aromatic ◽

Alkylated Polycyclic Aromatic Hydrocarbons

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ChemInform Abstract: Thermodynamic Stability of Polycyclic Aromatic Hydrocarbons Detected in Our Environment

ChemInform ◽

10.1002/chin.198841320 ◽

1988 ◽

Vol 19 (41) ◽

Author(s):

J. AIHARA

Keyword(s):

Polycyclic Aromatic Hydrocarbons ◽

Aromatic Hydrocarbons ◽

Thermodynamic Stability ◽

Polycyclic Aromatic

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Parent and alkylated polycyclic aromatic hydrocarbons in surface sediments of mangrove wetlands across Taiwan Strait, China: Characteristics, sources and ecological risk assessment

Chemosphere ◽

10.1016/j.chemosphere.2020.129168 ◽

2021 ◽

Vol 265 ◽

pp. 129168

Author(s):

Qi Huang ◽

Yaxian Zhu ◽

Fang Wu ◽

Yong Zhang

Keyword(s):

Risk Assessment ◽

Polycyclic Aromatic Hydrocarbons ◽

Ecological Risk ◽

Ecological Risk Assessment ◽

Aromatic Hydrocarbons ◽

Surface Sediments ◽

Taiwan Strait ◽

Mangrove Wetlands ◽

Polycyclic Aromatic ◽

Alkylated Polycyclic Aromatic Hydrocarbons

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A new spectral deconvolution – Selected ion monitoring method for the analysis of alkylated polycyclic aromatic hydrocarbons in complex mixtures

Talanta ◽

10.1016/j.talanta.2014.02.068 ◽

2014 ◽

Vol 125 ◽

pp. 114-124 ◽

Cited By ~ 8

Author(s):

Albert Robbat ◽

Nicholas M. Wilton

Keyword(s):

Polycyclic Aromatic Hydrocarbons ◽

Aromatic Hydrocarbons ◽

Complex Mixtures ◽

Selected Ion Monitoring ◽

Spectral Deconvolution ◽

Monitoring Method ◽

Polycyclic Aromatic ◽

Alkylated Polycyclic Aromatic Hydrocarbons

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Oxidation of benzylic alcohols derived from alkylated polycyclic aromatic hydrocarbons (alk-PAH) by human alcohol dehydrogenases

10.1240/sav_gbm_2005_h_001352 ◽

2005 ◽

Vol 2005 (Fall) ◽

Author(s):

Ronny Kollock ◽

Walter Meinl ◽

Heiko Schneider ◽

Hansruedi Glatt

Keyword(s):

Polycyclic Aromatic Hydrocarbons ◽

Aromatic Hydrocarbons ◽

Alcohol Dehydrogenases ◽

Benzylic Alcohols ◽

Polycyclic Aromatic ◽

Alkylated Polycyclic Aromatic Hydrocarbons

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Evaluation of the phototoxicity of unsubstituted and alkylated polycyclic aromatic hydrocarbons to mysid shrimp (Americamysis bahia ): Validation of predictive models

Environmental Toxicology and Chemistry ◽

10.1002/etc.3733 ◽

2017 ◽

Vol 36 (8) ◽

pp. 2043-2049 ◽

Cited By ~ 8

Author(s):

Bryson E. Finch ◽

Solmaz Marzooghi ◽

Dominic M. Di Toro ◽

William A. Stubblefield

Keyword(s):

Polycyclic Aromatic Hydrocarbons ◽

Aromatic Hydrocarbons ◽

Predictive Models ◽

Polycyclic Aromatic ◽

Mysid Shrimp ◽

Alkylated Polycyclic Aromatic Hydrocarbons

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Comparison of In Situ and Ex Situ Equilibrium Passive Sampling for Measuring Freely Dissolved Concentrations of Parent and Alkylated Polycyclic Aromatic Hydrocarbons in Sediments

Environmental Toxicology and Chemistry ◽

10.1002/etc.4849 ◽

2020 ◽

Vol 39 (11) ◽

pp. 2169-2179

Author(s):

Mathias Reininghaus ◽

Thomas F. Parkerton ◽

Gesine Witt

Keyword(s):

Polycyclic Aromatic Hydrocarbons ◽

Aromatic Hydrocarbons ◽

Passive Sampling ◽

Ex Situ ◽

Polycyclic Aromatic ◽

Alkylated Polycyclic Aromatic Hydrocarbons

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Analysis of Isomeric Alkylated Polycyclic Aromatic Hydrocarbons by Matrix Isolation Fourier Transform Infrared Spectroscopy

Analytical Letters ◽

10.1080/00032717908067925 ◽

1979 ◽

Vol 12 (13) ◽

pp. 1347-1359 ◽

Cited By ~ 7

Author(s):

E. R. Hinton ◽

Gleb Mamantov ◽

E. L. Wehry

Keyword(s):

Fourier Transform ◽

Polycyclic Aromatic Hydrocarbons ◽

Infrared Spectroscopy ◽

Fourier Transform Infrared Spectroscopy ◽

Aromatic Hydrocarbons ◽

Matrix Isolation ◽

Fourier Transform Infrared ◽

Polycyclic Aromatic ◽

Alkylated Polycyclic Aromatic Hydrocarbons

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Distributions of polycyclic aromatic hydrocarbons and alkylated polycyclic aromatic hydrocarbons in Osaka Bay, Japan

Marine Pollution Bulletin ◽

10.1016/j.marpolbul.2014.04.004 ◽

2014 ◽

Vol 85 (2) ◽

pp. 558-565 ◽

Cited By ~ 24

Author(s):

Shizuho Miki ◽

Seiichi Uno ◽

Kazuki Ito ◽

Jiro Koyama ◽

Hiroyuki Tanaka

Keyword(s):

Polycyclic Aromatic Hydrocarbons ◽

Aromatic Hydrocarbons ◽

Osaka Bay ◽

Polycyclic Aromatic ◽

Alkylated Polycyclic Aromatic Hydrocarbons

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Directing Role of Organic Anion Transporters in the Excretion of Mercapturic Acids of Alkylated Polycyclic Aromatic Hydrocarbons

Drug Metabolism and Disposition ◽

10.1124/dmd.107.016964 ◽

2007 ◽

Vol 35 (10) ◽

pp. 1824-1831 ◽

Cited By ~ 9

Author(s):

Nadiya Bakhiya ◽

Monika Batke ◽

Janet Laake ◽

Bernhard H. Monien ◽

Heinz Frank ◽

...

Keyword(s):

Polycyclic Aromatic Hydrocarbons ◽

Aromatic Hydrocarbons ◽

Organic Anion ◽

Organic Anion Transporters ◽

Mercapturic Acids ◽

Anion Transporters ◽

Polycyclic Aromatic ◽

Alkylated Polycyclic Aromatic Hydrocarbons

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Development of a methodology for accurate quantitation of alkylated polycyclic aromatic hydrocarbons in petroleum and oil contaminated environmental samples

Analytical Methods ◽

10.1039/c4ay01393j ◽

2014 ◽

Vol 6 (19) ◽

pp. 7760-7771 ◽

Cited By ~ 37

Author(s):

Chun Yang ◽

Gong Zhang ◽

Zhendi Wang ◽

Zeyu Yang ◽

Bruce Hollebone ◽

...

Keyword(s):

Polycyclic Aromatic Hydrocarbons ◽

Aromatic Hydrocarbons ◽

Environmental Samples ◽

Polycyclic Aromatic ◽

Alkylated Polycyclic Aromatic Hydrocarbons

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