Dynamic method to measure partition coefficient and mass accommodation coefficient for gas‒particle interaction of phthalates

Abstract The particle-gas partition coefficient (Kp) and mass accommodation coefficient (α) are two parameters characterizing the gas-particle interaction of semi-volatile organic compounds (SVOCs). Most of the available methods for measuring Kp require equilibrium at the chamber outlet, implying substantial preliminary testing. The need to separate gas-phase and particle-phase SVOCs also reduces the method accuracy. Few studies measuring α for indoor-related SVOCs are available, and they usually ignore the wall loss of SVOCs, resulting in reduced measurement accuracy. To overcome these deficiencies, we developed a dynamic method coupling a laminar flow tube chamber and an SVOC mass transfer model. Using the interaction between gas-phase di-2-ethylhexyl phthalate (DEHP) and (NH4)2SO4 particles (with diameters in the range of 10–600 nm) as an example, experiments were performed to evaluate the effectiveness and accuracy of the dynamic method. For the experimental conditions investigated (temperature = 25 °C and relative humidity <10%), gas-particle interaction between DEHP and (NH4)2SO4 particles is governed by surface adsorption because (NH4)2SO4 particles are in solid state. In this case, gas-particle partitioning should be characterized by the surface-area-normalized partition coefficient (KpA). KpA and α were measured to be 260 ± 80 m and 0.20 ± 0.05, respectively. Both are consistent with results reported in the literature. The method applicability for other SVOC-particle combinations and the improvement of method accuracy require further study. Copyright © 2019 American Association for Aerosol Research

[1]  Bin Zhao,et al.  Comparison of the predicted concentration of outdoor originated indoor polycyclic aromatic hydrocarbons between a kinetic partition model and a linear instantaneous model for gas-particle partition , 2012 .

[2]  Yinping Zhang,et al.  Simplifying analysis of sorption of SVOCs to particles: Lumped parameter method and application condition , 2016 .

[3]  Charles J. Weschler,et al.  Phthalates in Indoor Dust and Their Association with Building Characteristics , 2005, Environmental health perspectives.

[4]  J. C. Jaeger,et al.  Conduction of Heat in Solids , 1952 .

[5]  John H. Seinfeld,et al.  Size distribution dynamics reveal particle-phase chemistry in organic aerosol formation , 2013, Proceedings of the National Academy of Sciences.

[6]  A model of aerosol evaporation kinetics in a thermodenuder , 2009 .

[7]  D. Mackay,et al.  Gas--particle partitioning of organic compounds and its interpretation using relative solubilities. , 2001, Environmental science & technology.

[8]  U. Matson,et al.  Indoor and outdoor concentrations of ultrafine particles in some Scandinavian rural and urban areas. , 2005, The Science of the total environment.

[9]  Maud Pelletier,et al.  Distributions of the particle/gas and dust/gas partition coefficients for seventy-two semi-volatile organic compounds in indoor environment. , 2016, Chemosphere.

[10]  Rachel Morello-Frosch,et al.  Semivolatile Organic Compounds in Homes: Strategies for Efficient and Systematic Exposure Measurement Based on Empirical and Theoretical Factors , 2014, Environmental science & technology.

[11]  A. Khlystov,et al.  Determination of evaporation coefficients of semi-volatile organic aerosols using an integrated volume—tandem differential mobility analysis (IV-TDMA) method , 2009 .

[12]  Yinping Zhang,et al.  Indoor particle age, a new concept for improving the accuracy of estimating indoor airborne SVOC concentrations, and applications , 2018 .

[13]  Ying Xu,et al.  Predicting emissions of SVOCs from polymeric materials and their interaction with airborne particles. , 2006, Environmental science & technology.

[14]  C. Bornehag,et al.  Phthalate exposure and asthma in children. , 2010, International journal of andrology.

[15]  W. P. Kelly,et al.  Measurement of Particle Density by Inertial Classification of Differential Mobility Analyzer–Generated Monodisperse Aerosols , 1992 .

[16]  E. Robinson,et al.  Vapor wall loss of semi-volatile organic compounds in a Teflon chamber , 2016 .

[17]  J. Mo,et al.  Understanding and controlling airborne organic compounds in the indoor environment: mass transfer analysis and applications. , 2016, Indoor air.

[18]  John C. Little,et al.  Simple Method To Measure the Vapor Pressure of Phthalates and Their Alternatives. , 2016, Environmental science & technology.

[19]  J. Spengler,et al.  Phthalates, alkylphenols, pesticides, polybrominated diphenyl ethers, and other endocrine-disrupting compounds in indoor air and dust. , 2003, Environmental science & technology.

[20]  Holger M Koch,et al.  Assessing Human Exposure to Organic Pollutants in the Indoor Environment. , 2018, Angewandte Chemie.

[21]  T. Salthammer,et al.  Application of the Junge- and Pankow-equation for estimating indoor gas/particle distribution and exposure to SVOCs , 2015 .

[22]  John C. Little,et al.  Particle/Gas Partitioning of Phthalates to Organic and Inorganic Airborne Particles in the Indoor Environment. , 2018, Environmental science & technology.

[23]  Andrea Polidori,et al.  Gas/particle distribution of polycyclic aromatic hydrocarbons in coupled outdoor/indoor atmospheres , 2003 .

[24]  J. Cao,et al.  A SPME‐based method for rapidly and accurately measuring the characteristic parameter for DEHP emitted from PVC floorings , 2016, Indoor air.

[25]  E. J. Davis,et al.  A history and state-of-the-art of accommodation coefficients , 2006 .

[26]  Andrea R. Ferro,et al.  Estimating the Resuspension Rate and Residence Time of Indoor Particles , 2008, Journal of the Air & Waste Management Association.

[27]  Chenyang Bi,et al.  Modeling and analysis of sampling artifacts in measurements of gas-particle partitioning of semivolatile organic contaminants using filter-sorbent samplers , 2015 .

[28]  Bin Zhao,et al.  Analysis of the Dynamic Interaction Between SVOCs and Airborne Particles , 2013 .

[29]  Thomas E McKone,et al.  Indoor particulate matter of outdoor origin: importance of size-dependent removal mechanisms. , 2002, Environmental science & technology.

[30]  Yinping Zhang,et al.  Influence of airborne particles on convective mass transfer of SVOCs on flat surfaces: Novel insight and estimation formula , 2017 .

[31]  Hisashi Kobayashi,et al.  Modeling and analysis , 1978 .

[32]  S. Madronich,et al.  Impact of chamber wall loss of gaseous organic compounds on secondary organic aerosol formation: explicit modeling of SOA formation from alkane and alkene oxidation , 2015 .

[33]  Kebin He,et al.  The characteristics of PM2.5 in Beijing, China , 2001 .

[34]  S. Martin,et al.  Influence of Particle Physical State on the Uptake of Medium-Sized Organic Molecules. , 2018, Environmental science & technology.

[35]  John C. Little,et al.  Adsorption of Phthalates on Impervious Indoor Surfaces. , 2017, Environmental science & technology.

[36]  Ulrich Pöschl,et al.  Gas uptake and chemical aging of semisolid organic aerosol particles , 2011, Proceedings of the National Academy of Sciences.

[37]  W. Nazaroff Indoor particle dynamics. , 2004, Indoor air.

[38]  John Villadsen,et al.  The Graetz problem with axial heat conduction , 1974 .

[39]  Maud Pelletier,et al.  Temperature dependence of the particle/gas partition coefficient: An application to predict indoor gas-phase concentrations of semi-volatile organic compounds. , 2016, The Science of the total environment.

[40]  Alvin C.K. Lai,et al.  Modeling Indoor Particle Deposition from Turbulent Flow onto Smooth Surfaces , 2000 .

[41]  D. Worsnop,et al.  Mass accommodation and chemical reactions at gas-liquid interfaces. , 2006, Chemical reviews.

[42]  J. Pankow An absorption model of GAS/Particle partitioning of organic compounds in the atmosphere , 1994 .

[43]  Ling Chen,et al.  Polybrominated Diphenyl Ethers (PBDEs) in PM2.5, PM10, TSP and Gas Phase in Office Environment in Shanghai, China: Occurrence and Human Exposure , 2015, PloS one.

[44]  Xinke Wang,et al.  Indoor phthalate concentration and exposure in residential and office buildings in Xi'an, China , 2014 .

[45]  P. B. Allen Conduction of Heat. , 1983 .

[46]  John C. Little,et al.  Rapid methods to estimate potential exposure to semivolatile organic compounds in the indoor environment. , 2012, Environmental science & technology.

[47]  Zhishi Guo A framework for modelling non-steady-state concentrations of semivolatile organic compounds indoors – II. Interactions with particulate matter , 2014 .

[48]  K. Kannan,et al.  Occurrence of Phthalate Diesters in Particulate and Vapor Phases in Indoor Air and Implications for Human Exposure in Albany, New York, USA , 2015, Archives of Environmental Contamination and Toxicology.

[49]  A. Abdel-azim Fundamentals of Heat and Mass Transfer , 2011 .

[50]  J. Seinfeld,et al.  Atmospheric Chemistry and Physics: From Air Pollution to Climate Change , 1997 .

[51]  Jianping Cao,et al.  Potential role of intraparticle diffusion in dynamic partitioning of secondary organic aerosols , 2018, Atmospheric Pollution Research.

[52]  Frank P. Incropera,et al.  Fundamentals of Heat and Mass Transfer , 1981 .

[53]  Yirui Liang,et al.  Improved method for measuring and characterizing phthalate emissions from building materials and its application to exposure assessment. , 2014, Environmental science & technology.

[54]  John C. Little,et al.  Characterizing gas-particle interactions of phthalate plasticizer emitted from vinyl flooring. , 2013, Environmental science & technology.

[55]  Charles J. Weschler,et al.  Partitioning of phthalates among the gas phase, airborne particles and settled dust in indoor environments , 2008 .

[56]  J. Klánová,et al.  Distribution of legacy and emerging semivolatile organic compounds in five indoor matrices in a residential environment. , 2016, Chemosphere.

[57]  Yinping Zhang,et al.  Role of aerosols in enhancing SVOC flux between air and indoor surfaces and its influence on exposure , 2012 .

[58]  Paul D. Jones,et al.  Polybrominated Diphenyl Ethers (PBDEs) , 2005 .

[59]  Jinsoo Park,et al.  Measuring and predicting the emission rate of phthalate plasticizer from vinyl flooring in a specially-designed chamber. , 2012, Environmental science & technology.

[60]  W. Nazaroff,et al.  SVOC partitioning between the gas phase and settled dust indoors , 2010 .

[61]  P. Ziemann,et al.  Direct Measurements of Gas/Particle Partitioning and Mass Accommodation Coefficients in Environmental Chambers. , 2017, Environmental science & technology.

[62]  John C. Little,et al.  Modeling the formation and growth of organic films on indoor surfaces , 2018, Indoor air.

[63]  A. Robinson,et al.  Time scales for gas-particle partitioning equilibration of secondary organic aerosol formed from alpha-pinene ozonolysis. , 2013, Environmental science & technology.

[64]  J C Little,et al.  The effect of ventilation on indoor exposure to semivolatile organic compounds. , 2014, Indoor air.

[65]  A. Khlystov,et al.  Determination of Evaporation Coefficients of Ambient and Laboratory-Generated Semivolatile Organic Aerosols from Phase Equilibration Kinetics in a Thermodenuder , 2012 .

[66]  S. Pandis,et al.  The mass accommodation coefficient of ammonium nitrate aerosol , 1999 .

[67]  A. Covaci,et al.  Influence of suspended particles on the emission of organophosphate flame retardant from insulation boards , 2016, Environmental Science and Pollution Research.

[68]  Maud Pelletier,et al.  Predicting the gas-phase concentration of semi-volatile organic compounds from airborne particles: Application to a French nationwide survey. , 2017, The Science of the total environment.

[69]  W. Tao,et al.  Pore-scale modelling of dynamic interaction between SVOCs and airborne particles with lattice Boltzmann method , 2016 .

[70]  William W. Nazaroff,et al.  Semivolatile organic compounds in indoor environments , 2008 .

[71]  Qun Chen,et al.  Influence of suspended particles on indoor semi-volatile organic compounds emission , 2013 .

[72]  Ying Xu,et al.  A reference method for measuring emissions of SVOCs in small chambers , 2016 .

[73]  D. Vernez,et al.  Skin permeation and metabolism of di(2-ethylhexyl) phthalate (DEHP). , 2014, Toxicology letters.

[74]  T. Urase,et al.  Retention of a wide variety of organic pollutants by different nanofiltration/reverse osmosis membranes: controlling parameters of process , 2003 .

[75]  P. Ziemann,et al.  Measurements of the H2SO4 mass accommodation coefficient onto polydisperse aerosol , 1997 .

[76]  A. Zelenyuk,et al.  Evaporation kinetics and phase of laboratory and ambient secondary organic aerosol , 2011, Proceedings of the National Academy of Sciences.