Skip to main content
SpringerLink
Log in

Determination of the Hansen Solubility Parameter from the Structural Composition Data of Solvent Molecules

  • RESEARCH
  • Published:
Chemistry and Technology of Fuels and Oils Aims and scope

A method for calculating the Hansen solubility parameter of organic solvents by taking the sum of the contribution of each structural element of a solvent molecule is considered. Two variants are proposed for calculating this parameter. Comparison of the calculated and experimental values of these parameters fora 20 organic compounds of different classes showed satisfactory accuracy of the proposed calculation procedure. Feasibility was demonstrated for the use of this method of selecting solvents for dissolving polymers as well as for calculating some physicochemical characteristics of solvents such as molar volume, enthalpy of formation, and Gibbs free energy.

This is a preview of subscription content, log in via an institution to check access.

Access this article

Log in via an institution

Price excludes VAT (USA)
Tax calculation will be finalised during checkout.

Instant access to the full article PDF.

Institutional subscriptions

Fig. 1.
Fig. 2.
Fig. 3.
Fig. 4.

Similar content being viewed by others

References

  1. C. M. Hansen, Hansen Solubility Parameters. A User’s Handbook, CRC Press Taylor & Francis Group, Boca Raton, US (2006).

  2. S. Dimitris and I. Achilias, Recent Advances in the Chemical Recycling of Polymers, vol. 3, IntechOpen (2012), p. 64.

  3. I. G. Kaplan, Introduction into the Theory of Intermolecular Interactions [in Russian], Nauka, Moscow (1982).

    Google Scholar 

  4. D. W. Van Krevelen, Properties of Polymers, Their Estimation and Correlation with Chemical Structure, Elsevier, Amsterdam‑Oxford‑New York (1976).

  5. A. M. Pol’maliev, D. A. Zekel’, A. U. Dandaev, et al., Zhurnal Prikadnoi Khimii, 94, No. 1, 55‑63 (2021).

  6. P. A. Small, “Some Factors Affecting the Solubility of Polymers,” J. Appl. Chem., 3, No. 2, 71‑88 (1953).

    Article  CAS  Google Scholar 

  7. J. Gao, S. Wu, and M. A. Rogers, J. Mat. Chem., 22, No. 25, 12651‑12658 (2012).

    Article  CAS  Google Scholar 

  8. L. Stull, E. Westrum, and G. Sinke, Chemical Thermodynamics of Organic Compounds, John Wiley & Sons, New York (1969).

    Google Scholar 

  9. V. A. Rabinovich and Z. Ya. Khavin, Short Chemical Handbook [in Russian], Leningrad (1977).

Download references

Acknowledgments

This study was carried out at the Institute of Petrochemical Synthesis of the Russian Academy of Sciences with a grant from the Russian Science Fund (Project No. 17‑73‑30046).

Author information

Authors and Affiliations

  1. Topchiev Institute of Petrochemical Synthesis, Russian Academy of Sciences, Moscow, Russia

    A. M. Gyul’maliev, L. A. Zekel’ & Kh.M. Kadiev

  2. Gubkin University, Moscow, Russia

    F. G. Zhagfarov

Authors
  1. A. M. Gyul’maliev
    View author publications

    You can also search for this author in PubMed Google Scholar

  2. L. A. Zekel’
    View author publications

    You can also search for this author in PubMed Google Scholar

  3. Kh.M. Kadiev
    View author publications

    You can also search for this author in PubMed Google Scholar

  4. F. G. Zhagfarov
    View author publications

    You can also search for this author in PubMed Google Scholar

Corresponding author

Correspondence to A. M. Gyul’maliev.

Additional information

Translated from Khimiya i Tekhnologiya Topliv i Masel, No. 4, pp. 77–83, July – August, 2023.

Rights and permissions

Springer Nature or its licensor (e.g. a society or other partner) holds exclusive rights to this article under a publishing agreement with the author(s) or other rightsholder(s); author self-archiving of the accepted manuscript version of this article is solely governed by the terms of such publishing agreement and applicable law.

Reprints and permissions

About this article

Check for updates. Verify currency and authenticity via CrossMark

Cite this article

Gyul’maliev, A.M., Zekel’, L.A., Kadiev, K. et al. Determination of the Hansen Solubility Parameter from the Structural Composition Data of Solvent Molecules. Chem Technol Fuels Oils 59, 748–755 (2023). https://doi.org/10.1007/s10553-023-01580-y

Download citation

  • Published:

  • Issue Date:

  • DOI: https://doi.org/10.1007/s10553-023-01580-y

Keywords

Search

Navigation