Flash-Point Prediction of Binary Partially Miscible Aqueous-Organic Mixtures from UNIFAC Group Contribution Methods

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Flash point is one of the most important variables used to characterize fire and explosion hazard of liquids. This paper predicts the flash point of binary partially miscible aqueous mixtures by using the flash point prediction model of Liaw et al. handling non-ideal behavior through liquid phase activity coefficients evaluated with UNIFAC-type models, which do not need experimentally regressed binary parameters. Validation of this entirely predictive model is conclusive with the experimental data over the entire flammable composition range. Overall, the proposed method predicted the experimental data very well. Potential application for this approach concerns the classification of flammable liquid mixtures in the implementation of GHS.

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Advanced Materials Research (Volumes 560-561)

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1178-1183

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August 2012

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© 2012 Trans Tech Publications Ltd. All Rights Reserved

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[1] H.-J. Liaw, Y.-H. Lee, C.-L. Tang, H.-H. Hsu, J.-H. Liu, "A mathematical model for predicting the flash point of binary solutions," J. Loss Prev. Proc., vol. 15, pp.429-438, 2002.

DOI: 10.1016/s0950-4230(02)00068-2

Google Scholar

[2] H.-J. Liaw, Y.-Y. Chiu, "The prediction of the flash point for binary aqueous-organic solutions," J. Hazard. Mater., vol. 101, pp.83-106, 2003.

DOI: 10.1016/s0304-3894(03)00168-7

Google Scholar

[3] H.-J. Liaw, Y.-Y. Chiu, "A general model for predicting the flash point of miscible mixture," J. Hazard. Mater., vol. 137, pp.38-46, 2006.

Google Scholar

[4] H.-J. Liaw, V. Gerbaud, C.-Y. Chiu, "Flash point for ternary partially miscible mixtures of flammable solvents," J. Chem. Eng. Data, vol. 55, pp.134-146, 2010.

DOI: 10.1021/je900287r

Google Scholar

[5] H.-J. Liaw, V. Gerbaud, C.-C. Chen, C.-M. Shu, "Effect of Stirring on the Safety of Flammable Liquid Mixtures," J. Hazard. Mater., vol. 177 pp.1093-1101, 2010.

DOI: 10.1016/j.jhazmat.2010.01.033

Google Scholar

[6] D.A. Crowl, J.F. Louvar, Chemical Process Safety: Fundamentals with Applications, 2nd ed., Prentice Hall PTR, New Jersey, 2002.

Google Scholar

[7] CCPS/AIChE, Guidelines for Engineering Design for Process Safety, 1st ed., American Institute of Chemical Engineers, New York, 1993.

Google Scholar

[8] H.-J. Liaw, C.-L. Tang, J.-S. Lai, "A model for predicting the flash point of ternary flammable solutions of liquid," Combust. Flame, vol. 138, pp.308-319, 2004.

DOI: 10.1016/j.combustflame.2004.06.002

Google Scholar

[9] H.-J. Liaw, T.-A. Wang, "A non-ideal model for predicting the effect of dissolved salt on the flash point of solvent mixtures," J. Hazard. Mater., vol. 141, pp.193-201, 2007.

DOI: 10.1016/j.jhazmat.2006.06.108

Google Scholar

[10] L. Catoire, S. Paulmier, V. Naudet, "Estimation of closed cup flash points of combustible solvent blends," J. Phys. Chem. Ref. Data, vol. 35, pp.9-14, 2006.

DOI: 10.1063/1.1928236

Google Scholar

[11] J. Gmehling, P. Rasmussen, "Flash points of flammable liquid mixtures using UNIFAC," Ind. Eng. Chem. Fundam., vol. 21, pp.186-188, 1982.

DOI: 10.1021/i100006a016

Google Scholar

[12] H.-J. Liaw, W.-H. Lu, V. Gerbaud, C.-C. Chen, "Flash-point prediction for binary partially miscible mixtures of flammable solvents," J. Hazard. Mater., vol. 153, pp.1165-1175, 2008.

DOI: 10.1016/j.jhazmat.2007.09.078

Google Scholar

[13] H.-J. Liaw, C.-T. Chen, V. Gerbaud, "Flash-point prediction for binary partially miscible aqueous-organic mixtures," Chem. Eng. Sci., vol. 63, pp.4543-4554, 2008.

DOI: 10.1016/j.ces.2008.06.005

Google Scholar

[14] H.-J. Liaw, V. Gerbaud, H.-T. Wu, "Flash point measurements and modeling for ternary partially miscible aqueous-organic mixtures," J. Chem. Eng. Data, vol. 55, pp.3451-3461, 2010. A. Fredenslund, R.L. Jones, J.M. Prausnitz, "Group contribution estimation of activity coefficients in nonideal liquid mixtures," AIChE J., vol. 21, pp.1086-1099, 1975.

DOI: 10.1021/je100163q

Google Scholar

[15] M. Vidal, W.J. Rogers, M.S. Mannan, "Prediction of minimum flash point behaviour for binary mixtures," Process Saf. Environ. Prot., vol. 84, pp.1-9, 2006.

DOI: 10.1205/psep.05041

Google Scholar

[16] U. Weidlich, J. Gmehling, "A modified UNIFAC model. 1. prediction of VLE, hE, and g¥," Ind. Eng. Chem. Res., vol. 26, pp.1372-1381, 1987.

DOI: 10.1021/ie00067a018

Google Scholar

[17] J. Gmehling, J. Li, M. Schiller, "A modified UNIFAC model. 2. Present parameter matrix and results for different thermodynamic properties," Ind. Eng. Chem. Res., vol. 32, pp.178-193, 1993.

DOI: 10.1021/ie00013a024

Google Scholar

[18] T. Magnussen, P. Rasmussen, A. Fredenslund, "UNIFAC parameter table for prediction of liquid-liquid equilibria," Ind. Eng. Chem. Process Des Dev., vol. 20, pp.331-339, 1981.

DOI: 10.1021/i200013a024

Google Scholar

[19] H.-J. Liaw, Gerbaud, V., and Li, Y.H., "Prediction of miscible mixtures flash-point from UNIFAC group contribution methods," Fluid Phase Equilibr., vol. 300, pp.70-82, 2011.

DOI: 10.1016/j.fluid.2010.10.007

Google Scholar

[20] ASTM D 56, Standard Test Method for Flash Point by Tag Closed Tester, American Society for Testing and Materials, West Conshohocken, PA, 1999.

Google Scholar

[21] Gmehling, J., Onken, U., Arlt, W., 1981. Vapor-Liquid Equilibrium Data Collection, Part 1a. DECHEMA, Frankfurt, Germany.

DOI: 10.1002/cite.330540924

Google Scholar