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Henry's Law Constants

Rolf Sander

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Atmospheric Chemistry Division

Max-Planck Institute for Chemistry
Mainz, Germany

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Henry's Law Constants

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References

Errata

Contact, Impressum, Acknowledgements

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

Henry's Law Constants → Hydrocarbons (C, H) → Cycloalkanes → trans-1,2-dimethylcyclohexane

FORMULA:C6H10(CH3)2
CAS RN:6876-23-9
STRUCTURE
(FROM NIST):
InChIKey:KVZJLSYJROEPSQ-YUMQZZPRSA-N

Hcp d ln Hcp / d (1/T) Reference Type Notes
[mol/(m3Pa)] [K]
1.7×10−5 4600 Dohányosová et al. 2004 M
5.7×10−6 Abraham and Acree 2007 V
1.3×10−5 Mackay et al. 1993 V
4300 Kühne et al. 2005 Q
4600 Kühne et al. 2005 ?
2.1×10−5 Yaws and Yang 1992 ? 92)
Haynes 2014 W 117)

References

  • Abraham, M. H. and Acree, Jr., W. E.: Prediction of gas to water partition coefficients from 273 to 373 K using predicted enthalpies and heat capacities of hydration, Fluid Phase Equilib., 262, 97-110, doi:10.1016/J.FLUID.2007.08.011, 2007.
  • Dohányosová, P., Sarraute, S., Dohnal, V., Majer, V., and Costa Gomes, M.: Aqueous solubility and related thermodynamic functions of nonaromatic hydrocarbons as a function of molecular structure, Ind. Eng. Chem. Res., 43, 2805-2815, doi:10.1021/IE030800T, 2004.
  • Haynes, W. M., ed.: CRC Handbook of Chemistry and Physics, 95th Edition (Internet Version 2015), Taylor and Francis Group, 2014.
  • Kühne, R., Ebert, R.-U., and 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., and Ma, K. C.: Illustrated Handbook of Physical-Chemical Properties and Environmental Fate for Organic Chemicals, vol. III of Volatile Organic Chemicals , Lewis Publishers, Boca Raton, 1993.
  • Yaws, C. L. and Yang, H.-C.: Henry's law constant for compound in water, in: Thermodynamic and Physical Property Data, edited by Yaws, C. L., pp. 181-206, Gulf Publishing Company, Houston, TX, 1992.

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

92) Yaws and Yang (1992) give several references for the Henry's law constants but don't assign them to specific species.
117) Haynes (2014) refer to Mackay and Shiu (1981) but that article lists this value for 1,4-dimethylcyclohexane, not for 1,2-dimethylcyclohexane.

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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