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 Please do not cite the old paper anymore.
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FORMULA: | C9H14O5 |
InChIKey: | JDOROKVPYHJTEM-UHFFFAOYSA-N |
|
|
References |
Type |
Notes |
[mol/(m3Pa)] |
[K] |
|
|
|
1.7×108 |
|
Wang et al. (2017) |
Q |
81)
239)
|
1.0×106 |
|
Wang et al. (2017) |
Q |
81)
240)
|
4.9×105 |
|
Wang et al. (2017) |
Q |
81)
241)
|
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
-
Wang, C., Yuan, T., Wood, S. A., Goss, K.-U., Li, J., Ying, Q., & Wania, F.: Uncertain Henry’s law constants compromise equilibrium partitioning calculations of atmospheric oxidation products, Atmos. Chem. Phys., 17, 7529–7540, doi:10.5194/ACP-17-7529-2017 (2017).
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
81) |
Value at T = 288 K. |
239) |
Calculated using linear free energy relationships (LFERs). |
240) |
Calculated using SPARC Performs Automated Reasoning in Chemistry (SPARC). |
241) |
Calculated using COSMOtherm. |
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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