S. Ung et Mf. Doherty, SYNTHESIS OF REACTIVE DISTILLATION SYSTEMS WITH MULTIPLE EQUILIBRIUM CHEMICAL-REACTIONS, Industrial & engineering chemistry research, 34(8), 1995, pp. 2555-2565
We describe a procedure to determine the feasibility of separating mix
tures with multiple equilibrium chemical reactions by reactive distill
ation. The method involves describing the system in terms of new compo
sition coordinates which represent the reactive system in a lower dime
nsional composition space. The justification for these new variables i
s that when equilibrium chemical reactions occur in a mixture, the pha
se diagrams and fractionation diagrams are confined to be on surfaces
embedded within the mole fraction coordinate space, and are normally d
ifficult, if not impossible, to visualize and interpret. The new varia
bles represent these surfaces in a simpler way, thus giving an easier
visualization of the diagrams. The new variables sum to unity and they
take the same numerical values before and after reaction. In view of
these properties, the new variables behave like mole fractions in nonr
eactive mixtures and can be thought of as reaction-invariant compositi
ons. Therefore, the standard procedures used to determine the feasibil
ity and sequencing for nonreactive distillations can be applied, provi
ded the transformed composition variables are used. The procedure is d
emonstrated on the methyl tert-butyl ether process with the presence o
f inert, and on the separation of p- and m-xylene using di-tert-butylb
enzene as a reactive entrainer.