When referring to the compilation of Henry's Law Constants, please cite
this publication:
R. Sander: Compilation of Henry's law constants (version 4.0) for
water as solvent, Atmos. Chem. Phys., 15, 4399-4981 (2015),
doi:10.5194/acp-15-4399-2015
|
FORMULA: | C6H4(CH3)2 |
TRIVIAL NAME:
|
p-xylene
|
CAS RN: | 106-42-3 |
STRUCTURE
(FROM
NIST):
|
|
InChIKey: | URLKBWYHVLBVBO-UHFFFAOYSA-N |
Hcp |
d ln Hcp / d (1/T) |
Reference |
Type |
Notes |
[mol/(m3Pa)] |
[K] |
|
|
|
1.9×10−3 |
4200 |
Fogg and Sangster 2003 |
L |
|
1.3×10−3 |
4000 |
Staudinger and Roberts 2001 |
L |
|
1.3×10−3 |
3800 |
Staudinger and Roberts 1996 |
L |
|
1.4×10−3 |
|
Mackay and Shiu 1981 |
L |
|
1.3×10−3 |
|
Kim and Kim 2014 |
M |
|
1.4×10−3 |
|
Li et al. 2008 |
M |
|
2.0×10−3 |
|
Bobadilla et al. 2003 |
M |
|
1.4×10−3 |
|
Ryu and Park 1999 |
M |
|
1.5×10−3 |
|
Dohnal and Hovorka 1999 |
M |
|
1.5×10−3 |
2900 |
Kondoh and Nakajima 1997 |
M |
|
9.8×10−4 |
3200 |
Park et al. 1997 |
M |
|
1.7×10−3 |
4800 |
Dewulf et al. 1995 |
M |
|
1.2×10−3 |
3100 |
Hansen et al. 1993 |
M |
105)
|
1.3×10−3 |
|
Li and Carr 1993 |
M |
|
1.4×10−3 |
|
Li et al. 1993 |
M |
|
1.7×10−3 |
|
Zhang and Pawliszyn 1993 |
M |
|
1.2×10−3 |
5300 |
Bissonette et al. 1990 |
M |
|
1.3×10−3 |
3500 |
Ashworth et al. 1988 |
M |
103)
|
1.3×10−3 |
4800 |
Sanemasa et al. 1982 |
M |
|
6.1×10−4 |
|
Sato and Nakajima 1979a |
M |
19)
|
2.3×10−3 |
5400 |
Wasik and Tsang 1970 |
M |
|
1.8×10−4 |
|
Abraham and Acree 2007 |
V |
|
1.7×10−3 |
|
Mackay et al. 2006a |
V |
|
1.4×10−3 |
|
Shiu and Ma 2000 |
V |
|
1.5×10−3 |
|
Park et al. 1997 |
V |
|
1.7×10−3 |
|
Mackay et al. 1992a |
V |
|
1.5×10−3 |
|
Hwang et al. 1992 |
V |
|
1.8×10−3 |
|
Eastcott et al. 1988 |
V |
|
1.6×10−3 |
|
Hine and Mookerjee 1975 |
V |
|
1.6×10−3 |
4900 |
Andon et al. 1954 |
V |
129)
|
1.6×10−3 |
|
Bohon and Claussen 1951 |
V |
|
1.4×10−3 |
|
Foster et al. 1994 |
X |
137)
|
1.4×10−3 |
|
Sieg et al. 2008 |
C |
|
1.3×10−3 |
|
Schüürmann 2000 |
C |
7)
|
1.5×10−3 |
|
Hilal et al. 2008 |
Q |
|
|
4700 |
Kühne et al. 2005 |
Q |
|
1.1×10−3 |
|
Nirmalakhandan and Speece 1988a |
Q |
|
|
4500 |
Kühne et al. 2005 |
? |
|
1.6×10−3 |
|
Yaws and Yang 1992 |
? |
92)
|
1.4×10−3 |
|
Abraham et al. 1990 |
? |
|
References
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Bissonette, E. M., Westrick, J. J., and Morand, J. M.: Determination of Henry's coefficient for volatile organic compounds in dilute aqueous systems, in: Proceedings of the Annual Conference of the American Water Works Association, Cincinnati, OH, June 17-21, pp. 1913-1922, 1990.
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Dewulf, J., Drijvers, D., and van Langenhove, H.: Measurement of Henry's law constant as function of temperature and salinity for the low temperature range, Atmos. Environ., 29, 323-331, doi:10.1016/1352-2310(94)00256-K, 1995.
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Dohnal, V. and Hovorka, S.: Exponential saturator: a novel gas-liquid partitioning technique for measurement of large limiting activity coefficients, Ind. Eng. Chem. Res., 38, 2036-2043, doi:10.1021/IE980743H, 1999.
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Eastcott, L., Shiu, W. Y., and Mackay, D.: Environmentally relevant physical-chemical properties of hydrocarbons: A review of data and development of simple correlations, Oil Chem. Pollut., 4, 191-216, doi:10.1016/S0269-8579(88)80020-0, 1988.
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Fogg, P. and Sangster, J.: Chemicals in the Atmosphere: Solubility, Sources and Reactivity, John Wiley & Sons, Inc., 2003.
-
Foster, P., Ferronato, C., and Jacob, V.: Organic-compound transfer between gas-phase and raindrops - 1st experiments in a simulation chamber, Fresenius Environ. Bull., 3, 318-323, 1994.
-
Hansen, K. C., Zhou, Z., Yaws, C. L., and Aminabhavi, T. M.: Determination of Henry's law constants of organics in dilute aqueous solutions, J. Chem. Eng. Data, 38, 546-550, doi:10.1021/JE00012A017, 1993.
-
Hilal, S. H., Ayyampalayam, S. N., and Carreira, L. A.: Air-liquid partition coefficient for a diverse set of organic compounds: Henry's law constant in water and hexadecane, Environ. Sci. Technol., 42, 9231-9236, doi:10.1021/ES8005783, 2008.
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Hine, J. and Mookerjee, P. K.: The intrinsic hydrophilic character of organic compounds. Correlations in terms of structural contributions, J. Org. Chem., 40, 292-298, doi:10.1021/JO00891A006, 1975.
-
Hwang, Y.-L., Olson, J. D., and Keller, II, G. E.: Steam stripping for removal of organic pollutants from water. 2. Vapor-liquid equilibrium data, Ind. Eng. Chem. Res., 31, 1759-1768, doi:10.1021/IE00007A022, 1992.
-
Kühne, R., Ebert, R.-U., and Schüürmann, G.: Prediction of the temperature dependency of Henry's law constant from chemical structure, Environ. Sci. Technol., 39, 6705-6711, doi:10.1021/ES050527H, 2005.
-
Kim, Y.-H. and Kim, K.-H.: Recent advances in thermal desorption-gas chromatography-mass spectrometery method to eliminate the matrix effect between air and water samples: Application to the accurate determination of Henry's law constant, J. Chromatogr. A, 1342, 78-85, doi:10.1016/J.CHROMA.2014.03.040, 2014.
-
Kondoh, H. and Nakajima, T.: Optimization of headspace cryofocus gas chromatography/mass spectrometry for the analysis of 54 volatile organic compounds, and the measurement of their Henry's constants, J. Environ. Chem., 7, 81-89, doi:10.5985/JEC.7.81, 1997.
-
Li, J. and Carr, P. W.: Measurement of water-hexadecane partition coefficients by headspace gas chromatography and calculation of limiting activity coefficients in water, Anal. Chem., 65, 1443-1450, doi:10.1021/AC00058A023, 1993.
-
Li, J., Dallas, A. J., Eikens, D. I., Carr, P. W., Bergmann, D. L., Hait, M. J., and Eckert, C. A.: Measurement of large infinite dilution activity coefficients of nonelectrolytes in water by inert gas stripping and gas chromatography, Anal. Chem., 65, 3212-3218, doi:10.1021/AC00070A008, 1993.
-
Li, J.-Q., Shen, C.-Y., Xu, G.-H., Wang, H.-M., Jiang, H.-H., Han, H.-Y., Chu, Y.-N., and Zheng, P.-C.: Dynamic measurements of Henry's law constant of aromatic compounds using proton transfer reaction mass spectrometry, Acta Phys. Chim. Sin., 24, 705-708, 2008.
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Mackay, D. and Shiu, W. Y.: A critical review of Henry's law constants for chemicals of environmental interest, J. Phys. Chem. Ref. Data, 10, 1175-1199, doi:10.1063/1.555654, 1981.
-
Mackay, D., Shiu, W. Y., and Ma, K. C.: Illustrated Handbook of Physical-Chemical Properties and Environmental Fate for Organic Chemicals, vol. I of Monoaromatic Hydrocarbons, Chlorobenzenes, and PCBs , Lewis Publishers, Boca Raton, 1992a.
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Mackay, D., Shiu, W. Y., Ma, K. C., and Lee, S. C.: Handbook of Physical-Chemical Properties and Environmental Fate for Organic Chemicals, vol. I of Introduction and Hydrocarbons , CRC/Taylor & Francis Group, 2006a.
-
Nirmalakhandan, N. N. and Speece, R. E.: QSAR model for predicting Henry's constant, Environ. Sci. Technol., 22, 1349-1357, doi:10.1021/ES00176A016, 1988a.
-
Park, S.-J., Han, S.-D., and Ryu, S.-A.: Measurement of air/water partition coefficient (Henry's law constant) by using EPICS method and their relationship with vapor pressure and water solubility, J. Korean Inst. Chem. Eng., 35, 915-920, 1997.
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Ryu, S.-A. and Park, S.-J.: A rapid determination method of the air/water partition coefficient and its application, Fluid Phase Equilib., 161, 295-304, doi:10.1016/S0378-3812(99)00193-4, 1999.
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Sanemasa, I., Araki, M., Deguchi, T., and Nagai, H.: Solubility measurements of benzene and the alkylbenzenes in water by making use of solute vapor, Bull. Chem. Soc. Jpn., 55, 1054-1062, doi:10.1246/BCSJ.55.1054, 1982.
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-
Schüürmann, G.: Prediction of Henry's law constant of benzene derivatives using quantum chemical continuum-solvation models, J. Comput. Chem., 21, 17-34, doi:10.1002/(SICI)1096-987X(20000115)21:1<17::AID-JCC3>3.0.CO;2-5, 2000.
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-
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-
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-
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-
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Type
Table entries are sorted according to reliability of the data, listing
the most reliable type first: L) literature review, M) measured, V)
VP/AS = vapor pressure/aqueous solubility, R) recalculation, T)
thermodynamical calculation, X) original paper not available, C)
citation, Q) QSPR, E) estimate, ?) unknown, W) wrong. See Section 3.1
of Sander (2015) for further details.
Notes
7) |
Several references are given in the list of Henry's law constants but not assigned to specific species. |
19) |
Value at T = 310 K. |
92) |
Yaws and Yang (1992) give several references for the Henry's law constants but don't assign them to specific species. |
103) |
The value is most probably taken from the report by Howe et al. (1987). |
105) |
The same data were also published in Hansen et al. (1995). |
129) |
Calculated using Gh and Hh from Table 2 in Andon et al. (1954). Note that the thermodynamic functions in that table are not based on their α in Table 1. Instead, the expression exp(−Gh/(RT)) yields the Henry's law constant Hxp in the unit 1/atm. |
137) |
Value given here as quoted by HSDB (2015). |
The numbers of the notes are the same as
in Sander (2015). References cited in the notes can be
found here.
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