Residue Curve Map for Homogeneous Reactive Quaternary Mixtures
Author
Housam Binous
Title
Residue Curve Map for Homogeneous Reactive Quaternary Mixtures
Description
The two notebooks computes residue curve maps for the methyl acetate and isopropyl acetate chemistries at atmospheric pressure. These calculations involve solving a complex system of differential algebraic equations (DAEs). This can be readily achieved using the built-in function of Mathematica, FindRoot and Euler's method of integration. The governing equations, which depend on transformed compositions, can be found in the pioneering paper by Barbosa, D., and M. F. Doherty, Chemical Engineering Science, 3 (43), 541-550, 1988. Appropriate equations must be used to compute vapor-liquid equilibrium when there is dimerization in the gas phase. These equations have been derived by 1/ Marek, J.& Standart, G., Colln Czech. Chem. Commun., Engl. Edn, (19) 1074-1084, 1954; 2/ Marek, J. Colln Czech. Chem. Commun., Engl. Edn, (20) 1490-1502, 1955. Acetic acid, the associating component, is present in both quaternary mixtures. The occurrence of a chemical reaction leads to the disappearance of an ...
Category
Educational Materials
Keywords
URL
http://www.notebookarchive.org/2018-10-10qll5g/
DOI
https://notebookarchive.org/2018-10-10qll5g
Date Added
2018-10-02
Date Last Modified
2018-10-02
File Size
232.96 kilobytes
Supplements
Rights
Redistribution rights reserved




Residue Curve Map for Isopropyl Acetate Chemistry
Author's Data: Housam BINOUS
Department of Chemical Engineering
National Institute of Applied Sciences and Technology
Tunis, TUNISIA
Email: binoushousam@yahoo.com
Residue Curve Map for Isopropyl Acetate Chemistry
Author's Data: Housam BINOUS
Department of Chemical Engineering
National Institute of Applied Sciences and Technology
Tunis, TUNISIA
Email: binoushousam@yahoo.com
Author's Data: Housam BINOUS
Department of Chemical Engineering
National Institute of Applied Sciences and Technology
Tunis, TUNISIA
Email: binoushousam@yahoo.com
Activity Coefficients based on NRTL modelComponent 1: Acetic AcidComponent 2: IsopropanolComponent 3: Isopropyl AcetateComponent 4: Water
Gas Constant and Total Pressure
Vapor Pressure based on Antoine Equation and Normal Boiling Points
Equilibrium Constant for Dimerization of Acetic Acid
Equilibrium Constant for the esterification of acetic acid with isopropanol to give isopropyl acetate and water: CCOOH + CCH(OH)C ⇌ CCOOCH(C + O
H
3
H
3
H
3
H
3
H
3
)
2
H
2
Computation of Residue Curve Map takes approximately 5 minutes on a Pentium 800 MHz PC. Reactive Azeotrope compositions is : X1=0.231, X2=0.748 ( transformed compositions ) or x1=0.048, x2=0.565, x3=0.183, x4=0.204.


Cite this as: Housam Binous, "Residue Curve Map for Homogeneous Reactive Quaternary Mixtures" from the Notebook Archive (2005), https://notebookarchive.org/2018-10-10qll5g

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