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: | C12H6Br4O |
|
TRIVIAL NAME:
|
PBDE-47
|
|
CAS RN: | 5436-43-1 |
STRUCTURE
(FROM
NIST):
|
|
|
InChIKey: | XYBSIYMGXVUVGY-UHFFFAOYSA-N |
|
|
References |
Type |
Notes |
| [mol/(m3Pa)] |
[K] |
|
|
|
| 1.6×10−1 |
|
Lau et al. (2006) |
M |
262)
|
| 1.7×10−1 |
|
Lau et al. (2006) |
M |
263)
|
| 8.7×10−1 |
7300 |
Cetin and Odabasi (2005) |
M |
|
| 1.7×10−1 |
620 |
Charles and Destaillats (2005) |
M |
|
| 9.3×10−1 |
|
Kuramochi et al. (2014) |
V |
|
| 6.7×10−1 |
|
Tittlemier et al. (2002) |
V |
|
| 9.0×10−1 |
|
Wania and Dugani (2003) |
R |
|
| 2.2×10−1 |
|
Hilal et al. (2008) |
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
-
Cetin, B. & Odabasi, M.: Measurement of Henry’s law constants of seven polybrominated diphenyl ether (PBDE) congeners as a function of temperature, Atmos. Environ., 39, 5273–5280, doi:10.1016/J.ATMOSENV.2005.05.029 (2005).
-
Charles, M. J. & Destaillats, H.: Experimental determinations of Henry’s law constants of polybrominated diphenyl ethers (PBDEs) to evaluate exposure to aquatic biota, technical Completion Report, University of California Water Resources Center, UC Berkeley, http://escholarship.org/uc/item/9zv0s4np (2005).
-
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).
-
Kuramochi, H., Takigami, H., Scheringer, M., & Sakai, S.: Measurement of vapor pressures of selected PBDEs, hexabromobenzene, and 1,2-bis(2,4,6-tribromophenoxy)ethane at elevated temperatures, J. Chem. Eng. Data, 59, 8–15, doi:10.1021/JE400520E (2014).
-
Lau, F. K., Charles, M. J., & Cahill, T. M.: Evaluation of gas-stripping methods for the determination of Henry’s law constants for polybrominated diphenyl ethers and polychlorinated biphenyls, J. Chem. Eng. Data, 51, 871–878, doi:10.1021/JE050308B (2006).
-
Tittlemier, S. A., Halldorson, T., Stern, G. A., & Tomy, G. T.: Vapor pressures, aqueous solubilities, and Henry’s law constants of some brominated flame retardants, Environ. Toxicol. Chem., 21, 1804–1810, doi:10.1002/ETC.5620210907 (2002).
-
Wania, F. & Dugani, C. B.: Assessing the long-range transport potential of polybrominated diphenyl ethers: A comparison of four multimedia models, Environ. Toxicol. Chem., 22, 1252–1261, doi:10.1002/ETC.5620220610 (2003).
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
| 262) |
Modified gas-stripping method (MGSM), see Lau et al. (2006) for details. |
| 263) |
Integrated gas-stripping method (IGSM), see Lau et al. (2006) for details. |
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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