Solubility of fragrance raw materials in water: Experimental study, correlations, and Mod. UNIFAC (Do) predictions
Urszula Domańska-Żelazna , Kamil Paduszyński , Żaneta K. Niszczota
AbstractThe (liquid + liquid) and (solid + liquid) phase equilibria of nine binary mixtures containing fragrance raw materials (FRM) such as aliphatic ketones and compounds based on cyclohexane with water were investigated. The systems \2-heptanone, or 2-nonanone, or 2-undecanone, or 2-tridecanone, or cyclohexyl carboxylic acid (CCA), or cyclohexyl acetic acid (CAA), or 2-cyclohexyl ethanol (2CE) or cyclohexyl acetate (CA), or 2-cyclohexyl ethyl acetate (2CEA) + water (2)\ have been measured by a dynamic method in wide range of temperatures from (290 to 360) K and ambient pressure. For all systems immiscibility in the liquid phase was detected. The experimental data was correlated by means of the NRTL equation, utilizing parameters derived from the (liquid + liquid) equilibrium. Additionally, the binary mixtures were predicted with the Mod. UNIFAC (Do) model, with known from literature parameters, with very good results.
|Journal series||Journal of Chemical Thermodynamics, ISSN 0021-9614, (A 35 pkt)|
|Keywords in English||Correlation, Experimental (liquid + liquid), or (solid + liquid) phase equilibria, Mod. UNIFAC (Do) prediction, Molecular interactions|
|ASJC Classification||; ;|
|Publication indicators||= 1; : 2011 = 1.294; : 2011 = 2.422 (2) - 2011=2.173 (5)|
|Citation count*||2 (2014-09-23)|
* presented citation count is obtained through Internet information analysis and it is close to the number calculated by the Publish or Perish system.