Gas-wall partitioning of oxygenated organic compounds: Measurements, structure-activity relationships, and correlation with gas chromatographic retention factor

Aerosol Science and Technology

Volumn 49, Issue 9, 2015, Pages 727-738

  Yeh, Geoffrey K ^a,b   Ziemann, Paul J ^a,c  

^a UNIVERSITY OF CALIFORNIA   (United States)

^b GENENTECH INC   (United States)

^c UNIVERSITY OF COLORADO   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AEROSOLS; CARBON; CHEMICAL ANALYSIS; CHROMATOGRAPHY; ENVIRONMENTAL CHAMBERS; EQUILIBRIUM CONSTANTS; GASES; KETONES; MONOTERPENES; ORGANIC COMPOUNDS; POLYTETRAFLUOROETHYLENES;

AEROSOL MASS LOADING; CHROMATOGRAPHIC RETENTION; EQUILIBRIUM PARTITIONING; GAS CHROMATOGRAPHIC COLUMN; GAS-PARTICLE PARTITIONING; GAS-PHASE CONCENTRATION; SECONDARY ORGANIC AEROSOLS; STRUCTURE ACTIVITY RELATIONSHIPS;

GAS CHROMATOGRAPHY;

ALCOHOL DERIVATIVE; ALKANE DERIVATIVE; AROMATIC COMPOUND; CARBON 14; FUNCTIONAL GROUP; ISOPRENE; KETONE DERIVATIVE; ORGANIC COMPOUND; POLITEF; TERPENE DERIVATIVE;

ARTICLE; CHEMICAL REACTION; CONCENTRATION (PARAMETERS); GAS; GAS CHROMATOGRAPHY; PRIORITY JOURNAL; SECONDARY ORGANIC AEROSOL; STRUCTURE ACTIVITY RELATION; VAPOR PRESSURE;

EID: 84943397109     PISSN: 02786826     EISSN: 15217388     Source Type: Journal    
DOI: 10.1080/02786826.2015.1068427     Document Type: Article

References (28)

1. Aschmann, S. M., Arey, J., and Atkinson, R. (2013). Rate Constants for the Reactions of OH Radicals with 1,2,4,5-Tetramethylbenzene, Pentame-thylbenzene, 2,4,5-Trimethylbenzaldehyde, 2,4,5-Trimethylphenol, and 3-Methyl-3-Hexene-2, 5-Dione and Products of OH + 1,2,4,5-Tetramethylbenzene. J. Phys. Chem. A, 117:2556-2568.
2. Atkinson, R., and Arey, J. (2003). Atmospheric Degradation of Volatile Organic Compounds. Chem. Rev., 103:4605-4638.
3. Capouet, M., Muller, J.-F., Ceulemans, K., Compernolle, S., Vereecken, L., and Peeters, J. (2008). Modeling Aerosol Formation in Alpha-Pinene Photo-Oxidation Experiments. J. Geophys. Res., 113:D02308, DOI:10.1029/2007JD008995.
4. Compernolle, S., Ceulemans, K., and Muller, J.-F. (2011). EVAPORATION: A New Vapour Pressure Estimation Method for Organic Molecules Including Non-Additivity and Intramolecular Interactions. Atmos. Chem. Phys., 11:9431-9450.
5. Donovan, S. F. (1996). New Method for Estimating Vapor Pressure by the Use of Gas Chromatography. J. Chromatog. A, 749:123-129.
6. Fischer, R. C, Wittlinger, R., and Ballschmiter, K. (1992). Retention-Index Based Vapor Pressure Estimation for Polychlorobiphenyl (PCB) by Gas Chromatography. Fresen. J. Anal. Chem., 342:421-425.
7. Frisch, H. L. (1980). Sorption and Transport in Glassy Polymers-A Review, Polym. Eng. Sci, 20:2-13.
8. Gentner, D. R., Isaacman, G., Worton, D. R., Chan, A. W. H., Dallmann, T. R., Davis, L., Liu, S., Day, D. A., Russell, L. M., Wilson, K. R., Weber, R., Guha, A., Harley, R. A., and Goldstein, A. H. (2012). Elucidating Secondary Organic Aerosol from Diesel and Gasoline Vehicles through Detailed Characterization of Organic Carbon Emissions. P. Natl. Acad. Sci. USA, 109:18318-18323.
9. Hallquist, M., Wenger, J. C, Baltensperger, U., Rudich, Y., Simpson, D., Claeys, M., Dommen, J., Donahue, N. M., George, C, Goldstein, A. H., Hamilton, J. F., Herrmann, H., Hoffmann, T., Iinuma, Y., Jang, M., Jenkin, M. E., Jimenez, J. L., Kiendler-Scharr, A., Maenhaut, W., McFiggans, G., Mentel, T. F., Monod, A., Prevot, A. H. S., Seinfeld, J. H., Surratt, J. D., Szmigielski, R., and Wildt, J. (2009). The Formation, Properties and Impact of Secondary Organic Aerosol: Current and Emerging Issues. Atmos. Chem. Phys., 9:5155-5236.
10. Kroll, J. H., Chan, A. W. H., Ng, N. L., Flagan, R. C, and Seinfeld, J. H. (2007). Reactions of Semivolatile Organics and Their Effects on Secondary Organic Aerosol Formation. Environ. Sci. Technol., 41:3545-3550.
11. Lei, Y. D., Wania, F., and Shiu, W. Y. (1999). Vapor Pressures of the Polychlorinated Naphthalenes. J. Chem. Eng. Data, 44:577-582.
12. Loza, C. L., Chan, A. W. H., Galloway, M. M., Keutsch, F. N., Flagan, R. C, and Seinfeld, J. H. (2010). Characterization of Vapor Wall Loss in Laboratory Chambers. Environ. Sci. Technol., 44:5074-5078.
13. Loza, C. L., and Craven., J. S., Yee, L. D., Coggin, M. M., Schwantes, R. H., Shiraiwa, M., Zhang, X., Schilling, K. A., Ng, N. L., Canagaratna, M. R., Ziemann, P. J., Flagan, R.C., and Seinfeld, J. H. 2014. Secondary Organic Aerosol Yields of 12-Carbon Alkanes. Atmos. Chem. Phys., 14:1423-1439.
14. Luxenhofer, O., Schneider, M., Dambach, M., and Ballschmiter, K. (1996). Semivolatile Long Chain C6-C17 Alkyl Nitrates as Trace Compounds in Air. Chemosphere, 33:393-404.
15. Matsunaga, A., and Ziemann, P. J. (2010). Gas-Wall Partitioning of Organic Compounds in a Teflon Film Chamber and Potential Effects on Reaction Product and Aerosol Yield Measurements. Aerosol Sci. Tech., 44:881-892.
16. McMurry, P. H., and Grosjean, D. (1985). Gas and Aerosol Wall Losses in Teflon Film Smog Chambers. Environ. Sci. Technol., 19:1176-1182.
17. McVay, R., and Cappa., C. D., and Seinfeld, J. H. (2014). Vapor-Wall Deposition in Chambers: Theoretical Considerations. Environ. Sci. Technol., 48:10251-10258.
18. Meares, P. (1958). Diffusion of Allyl Chloride in Polyvinyl Acetate. Part II. The Transient State of Permeation. J. Polym. Sci., 27:405-418.
19. Pankow, J. F. (1994). An Absorption Model of Gas/Particle Partitioning of Organic Compounds in the Atmosphere. Atmos. Environ., 28:185-188.
20. Pankow, J. F., and Asher, W. E. (2008). SIMPOL.1: A Simple Group Contribution Method for Predicting Vapor Pressures and Enthalpies of Vaporization of Multifunctional Organic Compounds. Atmos. Chem. Phys., 8:2773-2796.
21. Paulot, F., and Crounse., J. D., Kjaergaard, H. G., Kroll, J. H., Seinfeld, J. H., and Wennberg, P. O. (2009). Isoprene Photooxidation: New Insights into the Production of Acids and Organic Nitrates. Atmos. Chem. Phys., 9: 1479-1501.
22. Seinfeld, J. H., and Erdakos., G. B., Asher, W. E., and Pankow, J. F. (2001). Modeling the Formation of Secondary Organic Aerosol (SOA). 2. The Predicted Effects of Relative Humidity of Aerosol Formation in the α-Pinene, Δ3-Carene, and Cyclohexene-Ozone Systems. Environ. Sci. Technol., 35:1806-1817.
23. Snyder, L. R., and Kirkland., J. J., and Glajch, J. L. (1997). Practical HPLC Method Development. 2nd ed. John Wiley, New York, p. 29.
24. x: Measured Yields with Essential Corrections for Gas-Wall Partitioning. J. Phys. Chem. A, 118:8147-8157.
25. x. J. Phys. Chem. A, 118:8797-8806.
26. Ziemann, P. J., and Atkinson, R. (2012). Kinetics, Products, and Mechanisms of Secondary Organic Aerosol Formation. Chem. Soc. Rev., 41:6582-6605.
27. Zhang, X., and Cappa., C. D., Jathar, S. H., McVay, R. C., Ensberg, J. J., Kleeman, M. J., and Seinfeld, J. H. (2014): Influence of Vapor Wall Loss in Laboratory Chambers on Yields of Secondary Organic Aerosol. P. Natl. Acad. Sci. USA, 111:5802-5807.
28. Zhang, X., and Schwantes., R. H., McVay, R. C., Lignell, H., Coggon, M. M., Flagan, R. C., and Seinfeld, J. H. (2015). Vapor Wall Deposition in Teflon Chambers. Atmos. Chem. Phys., 15:4197-4214.