Modified UNIFAC (Dortmund) Parameters for the Interaction between the Amino Group at Cycloaliphatic Hydrocarbon and the Hydroxyl Group
| Autor: | Jürgen Schmelzer, Grit Kalies, Thomas Hähnel, Mandy Klauck, Sandra Richter |
|---|---|
| Rok vydání: | 2019 |
| Předmět: |
chemistry.chemical_classification
General Chemical Engineering General Chemistry Cyclohexylamine Industrial and Manufacturing Engineering Isothermal process chemistry.chemical_compound Hydrocarbon chemistry Computational chemistry Group (periodic table) Methanol Ternary operation UNIFAC Aliphatic hydrocarbon |
| Zdroj: | Industrial & Engineering Chemistry Research. 58:21730-21738 |
| ISSN: | 1520-5045 0888-5885 |
| Popis: | Modified UNIFAC (Dortmund) parameters for the interactions of the amino group at cycloaliphatic hydrocarbon with the hydroxyl group or the methanol group were determined by means of literature and our own experimental data. The vapor–liquid equilibria of the three binary systems cyclohexylamine + 2-butanol, cyclohexylamine + 2-methyl-2-butanol, and cyclohexylamine + 1-hexanol were measured isothermally with the dynamic method. The predictions of phase equilibrium data using the new parameter set for the amino group at cycloaliphatic hydrocarbon are compared to the predictions using the amino group at aliphatic hydrocarbon. The improvement of the description of experimental data is shown for binary and ternary systems. |
| Databáze: | OpenAIRE |
| Externí odkaz: |
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