A structure–activity relationship (SAR) for predicting rate constants for the reaction of NO3, OH and O3 with monoalkenes and conjugated dienes

Literature Information

Publication Date
DOI 10.1039/A901193E
Impact Factor 3.676
Authors


View Original

Abstract

A simple method of predicting rate constants for the reaction between NO3, OH or O3 and substituted alkenes (monoalkenes and conjugated dienes) has been demonstrated using a simple structure–activity relationship (SAR) based on the structure of the alkene. The SAR is useful in providing an initial estimate of an unknown rate constant for a reaction of an alkene and the important tropospheric oxidants NO3, OH or O3.

Related Literature

Computer modeling of the complexes of Chlorin e6 with amphiphilic polymers

Anna B. Solov'eva, Nickolay S. Melik-Nubarov

2014-04-14 Paper

DOI: 10.1039/C3CP55510K

Carbon dioxide interaction with isolated imidazole or attached on gold clusters and surface: competition between σ H-bond and π stacking interaction

Muthuramalingam Prakash, Kévin Mathivon, David M. Benoit, Gilberte Chambaud, Majdi Hochlaf

2014-05-07 Paper

DOI: 10.1039/C4CP01292E

Insight into the structure and the mechanism of the slow proton transfer in the GFP double mutant T203V/S205A

Ron Simkovitch, Shay Shomer, Rinat Gepshtein, Dan Huppert, Mari Saif, Karen Kallio, S. James Remington

2014-04-14 Paper

DOI: 10.1039/C4CP00311J

Thermoresponsive fluorescence of a graphene–polymer composite based on a local surface plasmon resonance effect

Yunyun Huang, Wensheng Lin, Kan Chen, Wenkai Zhang, Xudong Chen, Ming Qiu Zhang

2014-03-14 Paper

DOI: 10.1039/C4CP00773E

Structural relaxation of vapor-deposited molecular glasses and supercooled liquids

Kikujiro Ishii, Hideyuki Nakayama

2014-04-24 Perspective

DOI: 10.1039/C4CP00458B

Electrical conductivity and glass formation in nitrile-functionalized pyrrolidinium bis(trifluoromethylsulfonyl)imide ionic liquids: chain length and odd–even effects of the alkyl spacer between the pyrrolidinium ring and the nitrile group

Jan Leys, Chandra Shekhar Pati Tripathi, Christ Glorieux, Stefan Zahn, Barbara Kirchner, Stéphane Longuemart, Kallidanthiyil Chellappan Lethesh, Peter Nockemann, Wim Dehaen, Koen Binnemans

2014-03-24 Paper

DOI: 10.1039/C4CP00259H

Constructing a mixed π-conjugated bridge to effectively enhance the nonlinear optical response in the Möbius cyclacene-based systems

Liwei Chen, Guangtao Yu, Wei Chen, Chunyun Tu, Xingang Zhao, Xuri Huang

2014-04-04 Paper

DOI: 10.1039/C4CP00733F

Adsorption and splitting of H2S on 2D-ZnO1−xNy: first-principles analysis

Summayya Kouser, Nacir Tit

2014-04-22 Paper

DOI: 10.1039/C4CP01092B

Mechanisms of enhanced sulfur tolerance on samarium (Sm)-doped cerium oxide (CeO2) from first principles

Hee Su Kim, Sung Pil Yoon, Jonghee Han, Chang Won Yoon, Sun Hee Choi, Suk Woo Nam, Hyung Chul Ham

2014-04-01 Paper

DOI: 10.1039/C4CP00777H

You might also like

Compound Q&A

What precautions should be taken when handling 4-Methyl-6-(trifluoromethyl)quinoline (CAS: 40716-16-3)?

When handling 4-Methyl-6-(trifluoromethyl)quinoline (CAS: 40716-16-3), safety go...

40716-16-34-Methyl-6-(trifluor...
Compound Q&A

What is 4-(3,5-Difluorophenyl)aniline (CAS: 405058-00-6)?

4-(3,5-Difluorophenyl)aniline is an aromatic organic compound with the CAS numbe...

405058-00-64-(3,5-Difluoropheny...
Compound Q&A

How is 5-{[4-(Trifluoromethyl)phenyl]sulfanyl}-1,2,3-thiadiazole-4-carboxylic acid (CAS: 338982-07-3) typically synthesized?

5-{[4-(Trifluoromethyl)phenyl]sulfanyl}-1,2,3-thiadiazole-4-carboxylic acid can ...

338982-07-35-{[4-(Trifluorometh...
Compound Q&A

What is the market or research trend for 4-Benzylaniline hydrochloride (CAS: 6317-57-3)?

The market for 4-Benzylaniline hydrochloride (CAS: 6317-57-3) is steadily growin...

6317-57-34-Benzylaniline hydr...
Compound Q&A

Is [3-(Diethylsulfamoyl)phenyl]boronic acid (CAS: 871329-58-7) safe?

[3-(Diethylsulfamoyl)phenyl]boronic acid is generally considered safe when handl...

871329-58-7[3-(Diethylsulfamoyl...
Compound Q&A

What are the main uses of 3-Bromo-2,5-dimethoxyaniline (CAS: 115929-62-9)?

3-Bromo-2,5-dimethoxyaniline is mainly used in the pharmaceutical and chemical i...

115929-62-93-Bromo-2,5-dimethox...
Compound Q&A

What regulatory guidelines apply to N-Methyl-1-(5-methyl-1H-indol-3-yl)methanamine (CAS: 915922-67-7)?

N-Methyl-1-(5-methyl-1H-indol-3-yl)methanamine (CAS: 915922-67-7) is subject to ...

915922-67-7N-Methyl-1-(5-methyl...
Compound Q&A

What industries use Carbamic acid, N-[(5S)-5,6-diamino-6-oxohexyl]-, 1,1-dimethylethyl ester (CAS: 24828-96-4)?

This compound is primarily used in the pharmaceutical industry for the synthesis...

24828-96-4Carbamic acid, N-[(5...
Compound Q&A

How should 2-Methyl-2-propanyl [(1S,3R)-3-aminocyclohexyl]carbamate (CAS: 1298101-47-9) be stored?

2-Methyl-2-propanyl [(1S,3R)-3-aminocyclohexyl]carbamate (CAS: 1298101-47-9) sho...

1298101-47-92-Methyl-2-propanyl ...
Compound Q&A

What industries use Ethyl 2-bromo-4,4,4-trifluorobutanoate (CAS: 367-33-9)?

Ethyl 2-bromo-4,4,4-trifluorobutanoate (CAS: 367-33-9) is utilized in the pharma...

367-33-9Ethyl 2-bromo-4,4,4-...

Source Journal

Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics
CiteScore: 5.5
Self-citation Rate: 10.3%
Articles per Year: 3036

Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.

Recommended Suppliers

Disclaimer
This page provides academic journal information for reference and research purposes only. We are not affiliated with any journal publishers and do not handle publication submissions. For publication-related inquiries, please contact the respective journal publishers directly.
If you notice any inaccuracies in the information displayed, please contact us at support@chemtradehub.com. We will promptly review and address your concerns.