When referring to the compilation of Henry's Law Constants, please cite
this publication:
R. Sander: Compilation of Henry's law constants (version 5.0.0) for
water as solvent, Atmos. Chem. Phys., 23, 10901-12440 (2023),
doi:10.5194/acp-23-10901-2023
The publication from 2023 replaces that from 2015,
which is now obsolete. Please do not cite the old paper anymore.
|
FORMULA: | C12H5Cl5 |
TRIVIAL NAME:
|
PCB-123
|
CAS RN: | 65510-44-3 |
STRUCTURE
(FROM
NIST):
|
|
InChIKey: | YAHNWSSFXMVPOU-UHFFFAOYSA-N |
|
|
References |
Type |
Notes |
[mol/(m3Pa)] |
[K] |
|
|
|
4.6×10−2 |
|
Fang et al. (2006) |
M |
|
3.7×10−3 |
5800 |
Paasivirta and Sinkkonen (2009) |
V |
|
1.1×10−1 |
|
Burkhard et al. (1985) |
V |
|
1.4×10−1 |
|
Lee (2007) |
Q |
723)
|
9.3×10−2 |
|
Lee (2007) |
Q |
724)
|
5.7×10−2 |
|
Dunnivant et al. (1992) |
Q |
|
3.8×10−2 |
|
Sabljić and Güsten (1989) |
Q |
|
Data
The first column contains Henry's law solubility constant
at the reference temperature of 298.15 K.
The second column contains the temperature dependence
, also at the
reference temperature.
References
-
Burkhard, L. P., Armstrong, D. E., & 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., Elzerman, A. W., Jurs, P. C., & 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, F., Chu, S., & Hong, C.-S.: Air–water Henry’s law constants for PCB congeners: experimental determination and modeling of structure-property relationship, Anal. Chem., 78, 5412–5418, doi:10.1021/AC0604742 (2006).
-
Lee, F. 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, ISBN 978-0-549-42141-2 (2007).
-
Paasivirta, J. & 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).
-
Sabljić, A. & Güsten, H.: Predicting Henry’s law constants for polychlorinated biphenyls, Chemosphere, 19, 1503–1511, doi:10.1016/0045-6535(89)90495-5 (1989).
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 (2023) for further details.
Notes
723) |
Calculated with the principal component regression (PCR) method; see Lee (2007) for details. |
724) |
Calculated with the partial least-square regression (PLSR) method; see Lee (2007) for details. |
The numbers of the notes are the same as
in Sander (2023). References cited in the notes can be
found here.
|
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