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
A new version is currently under peer review:
R. Sander: Compilation of Henry's law constants (version 5.0.0-rc.0)
for water as solvent,
doi:10.5194/egusphere-2023-1584
The database on this web page will be updated to
version 5.0.0 when the peer review of the manuscript is completed.
|
FORMULA: | C14H20ClNO2 |
CAS RN: | 15972-60-8 |
STRUCTURE
(FROM
NIST):
|
|
InChIKey: | XCSGPAVHZFQHGE-UHFFFAOYSA-N |
|
|
References |
Type |
Notes |
[mol/(m3Pa)] |
[K] |
|
|
|
6.7×102 |
|
Muir et al. (2004) |
L |
144)
|
9.9×102 |
|
Muir et al. (2004) |
L |
143)
|
1.4×102 |
9200 |
Gautier et al. (2003) |
M |
|
9.0×102 |
|
Fendinger et al. (1989) |
M |
126)
|
1.2×103 |
|
Fendinger and Glotfelty (1988) |
M |
126)
|
4.5×102 |
|
Mackay et al. (2006d) |
V |
|
1.6×102 |
|
Suntio et al. (1988) |
V |
9)
|
3.1×102 |
|
Glotfelty et al. (1987) |
V |
|
3.1×103 |
|
Hilal et al. (2008) |
Q |
|
|
11000 |
Kühne et al. (2005) |
Q |
|
8.2×104 |
|
Meylan and Howard (1991) |
Q |
|
|
9300 |
Kühne et al. (2005) |
? |
|
3.1×102 |
|
Chesters et al. (1989) |
? |
|
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
-
Chesters, G., Simsiman, G. V., Levy, J., Alhajjar, B. J., Fathulla, R. N., & Harkin, J. M.: Environmental fate of alachlor and metolachlor, Rev. Environ. Contam. Toxicol., 110, 1–74, doi:10.1007/978-1-4684-7092-5_1 (1989).
-
Fendinger, N. J. & Glotfelty, D. E.: A laboratory method for the experimental determination of air-water Henry’s law constants for several pesticides, Environ. Sci. Technol., 22, 1289–1293, doi:10.1021/ES00176A007 (1988).
-
Fendinger, N. J., Glotfelty, D. E., & Freeman, H. P.: Comparison of two experimental techniques for determining air/water Henry’s law constants, Environ. Sci. Technol., 23, 1528–1531, doi:10.1021/ES00070A013 (1989).
-
Gautier, C., Le Calvé, S., & Mirabel, P.: Henry’s law constants measurements of alachlor and dichlorvos between 283 and 298 K, Atmos. Environ., 37, 2347–2353, doi:10.1016/S1352-2310(03)00155-9 (2003).
-
Glotfelty, D. E., Seiber, J. N., & Liljedahl, A.: Pesticides in fog, Nature, 325, 602–605, doi:10.1038/325602A0 (1987).
-
Hilal, S. H., Ayyampalayam, S. N., & 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).
-
Kühne, R., Ebert, R.-U., & 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., Ma, K. C., & Lee, S. C.: Handbook of Physical-Chemical Properties and Environmental Fate for Organic Chemicals, vol. IV of Nitrogen and Sulfur Containing Compounds and Pesticides, CRC/Taylor & Francis Group (2006d).
-
Meylan, W. M. & Howard, P. H.: Bond contribution method for estimating Henry’s law constants, Environ. Toxicol. Chem., 10, 1283–1293, doi:10.1002/ETC.5620101007 (1991).
-
Muir, D. C. G., Teixeira, C., & Wania, F.: Empirical and modeling evidence of regional atmospheric transport of current-use pesticides, Environ. Toxicol. Chem., 23, 2421–2432, doi:10.1897/03-457 (2004).
-
Suntio, L. R., Shiu, W. Y., Mackay, D., Seiber, J. N., & Glotfelty, D.: Critical review of Henry’s law constants for pesticides, Rev. Environ. Contam. Toxicol., 103, 1–59, doi:10.1007/978-1-4612-3850-8_1 (1988).
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
9) |
Value at T = 293 K. |
126) |
Value at T = 296 K. |
143) |
Literature-derived value. |
144) |
Final adjusted value. |
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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