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: | C12H5Cl5 |
TRIVIAL NAME:
|
PCB-104
|
CAS RN: | 56558-16-8 |
STRUCTURE
(FROM
NIST):
|
|
InChIKey: | MTCPZNVSDFCBBE-UHFFFAOYSA-N |
Hcp |
d ln Hcp / d (1/T) |
Reference |
Type |
Notes |
[mol/(m3Pa)] |
[K] |
|
|
|
1.5×10−2 |
1700 |
Bamford et al. 2000 |
M |
|
1.1×10−2 |
|
Dunnivant et al. 1988 |
M |
|
1.1×10−2 |
|
Dunnivant and Elzerman 1988 |
M |
266)
|
2.8×10−3 |
6300 |
Paasivirta and Sinkkonen 2009 |
V |
|
4.3×10−2 |
|
Mackay et al. 2006b |
V |
|
7.2×10−2 |
|
Mackay et al. 1992a |
V |
|
5.4×10−3 |
|
Burkhard et al. 1985 |
V |
|
4.2×10−2 |
|
Fang Lee 2007 |
Q |
264)
|
3.4×10−2 |
|
Fang Lee 2007 |
Q |
265)
|
|
3100 |
Kühne et al. 2005 |
Q |
|
1.3×10−2 |
|
Dunnivant et al. 1992 |
Q |
|
|
2000 |
Kühne et al. 2005 |
? |
|
References
-
Bamford, H. A., Poster, D. L., and Baker, J. E.: Henry's law constants of polychlorinated biphenyl congeners and their variation with temperature, J. Chem. Eng. Data, 45, 1069-1074, doi:10.1021/JE0000266, 2000.
-
Burkhard, L. P., Armstrong, D. E., and Andren, A. W.: Henry's law constants for the polychlorinated biphenyls, Environ. Sci. Technol., 19, 590-596, doi:10.1021/ES00137A002, 1985.
-
Dunnivant, F. M. and Elzerman, A. W.: Aqueous solubility and Henry's law constant data for PCB congeners for evaluation of quantitative structure-property relationships (QSPRs), Chemosphere, 17, 525-541, doi:10.1016/0045-6535(88)90028-8, 1988.
-
Dunnivant, F. M., Coates, J. T., and Elzerman, A. W.: Experimentally determined Henry's law constants for 17 polychlorobiphenyl congeners, Environ. Sci. Technol., 22, 448-453, doi:10.1021/ES00169A013, 1988.
-
Dunnivant, F. M., Elzerman, A. W., Jurs, P. C., and Hasan, M. N.: Quantitative structure-property relationships for aqueous solubilities and Henry's law constants of polychlorinated biphenyls, Environ. Sci. Technol., 26, 1567-1573, doi:10.1021/ES00032A012, 1992.
-
Fang Lee, F.: Comprehensive analysis, Henry's law constant determination, and photocatalytic degradation of polychlorinated biphenyls (PCBs) and/or other persistent organic pollutants (POPs), Ph.D. thesis, University at Albany, State University of New York, USA, 2007.
-
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.
-
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.
-
Mackay, D., Shiu, W. Y., Ma, K. C., and Lee, S. C.: Handbook of Physical-Chemical Properties and Environmental Fate for Organic Chemicals, vol. II of Halogenated Hydrocarbons , CRC/Taylor & Francis Group, 2006b.
-
Paasivirta, J. and Sinkkonen, S. I.: Environmentally relevant properties of all 209 polychlorinated biphenyl congeners for modeling their fate in different natural and climatic conditions, J. Chem. Eng. Data, 54, 1189-1213, doi:10.1021/JE800501H, 2009.
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
264) |
Calculated with the principal component regression (PCR) method, see Fang Lee (2007) for details. |
265) |
Calculated with the partial least-square regression (PLSR) method, see Fang Lee (2007) for details. |
266) |
The same data were also published in Dunnivant et al. (1988). |
The numbers of the notes are the same as
in Sander (2015). References cited in the notes can be
found here.
|
* * *
Search Henry's Law Database
* * *
Convert Henry's Law Constants
* * *
|