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: | C9H17N5S |
CAS RN: | 834-12-8 |
STRUCTURE
(FROM
NIST):
|
|
InChIKey: | RQVYBGPQFYCBGX-UHFFFAOYSA-N |
Hcp |
d ln Hcp / d (1/T) |
Reference |
Type |
Notes |
[mol/(m3Pa)] |
[K] |
|
|
|
4.1×103 |
|
HSDB 2015 |
V |
|
8.1×103 |
|
Mackay et al. 2006d |
V |
|
8.3×103 |
|
Suntio et al. 1988 |
V |
9)
|
4.1×103 |
|
Delgado and Alderete 2003 |
C |
|
1.2×104 |
|
Hilal et al. 2008 |
Q |
|
5.1×103 |
|
Abraham et al. 2007 |
Q |
|
8.9×107 |
|
Delgado and Alderete 2003 |
Q |
|
1.1×107 |
|
Delgado and Alderete 2003 |
Q |
|
References
-
Abraham, M. A., Enomoto, K., Clarke, E. D., Rosés, M., Ràfols, C., and Fuguet, E.: Henry's law constants or air to water partition coefficients for 1,3,5-triazines by an LFER method, J. Environ. Monit., 9, 234-239, doi:10.1039/B617181H, 2007.
-
Delgado, E. J. and Alderete, J. B.: Prediction of Henry's law constants of triazine derived herbicides from quantum chemical continuum solvation models, J. Chem. Inf. Comput. Sci., 43, 1226-1230, doi:10.1021/CI0256485, 2003.
-
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.
-
HSDB: Hazardous Substances Data Bank, TOXicology data NETwork (TOXNET), National Library of Medicine (US), http://toxnet.nlm.nih.gov/newtoxnet/hsdb.htm, 2015.
-
Mackay, D., Shiu, W. Y., Ma, K. C., and 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.
-
Suntio, L. R., Shiu, W. Y., Mackay, D., Seiber, J. N., and 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
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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