Professional Documents
Culture Documents
Our batch reactor contains a heat exchanger in the form of coiled loops
through which an isothermal condensing fluid flows, thereby heating
the liquid contents of the reactor. The heat accumulating in the reactor’s
contents equals the rate of heat transfer from the coiled loops; that is
dT
VLiquid ρLiq cP=Liq 5 UAðTHeatFluid 2 TÞ
dt
where VLiquid is the liquid volume in the reactor (m3); ρLiq is the den-
sity of the liquid in the reactor (kg/m3); cP/Liq is the specific heat capac-
ity of the liquid in the reactor (m2/K s2); T is the temperature of the
liquid in the reactor (K); t is the time (s); U is the overall heat transfer
coefficient for the coiled loops in the reactor (kg/K s3); A is the heat
transfer surface area of the coiled loops (m2); and THeatFluid is the tem-
perature of the heating medium flowing through the coiled loops (K).
Rearranging gives
!
dT UA
5 ðTHeatFluid 2 TÞ
dt VLiquid ρLiq cP=Liq
Finally, moving the negative sign inside the logarithm function gives
!
THeatFluid 2 TInitial UA
ln 5 t
THeatFluid 2 TReaction VLiquid ρLiq cP=Liq
This equation gives the time required to heat the liquid volume in
the batch reactor from its initial temperature to the specified reaction
Batch and Semi-Batch Operations 87
and gives
dT TInlet 2 T
VLiq ρLiq cP=Liq 5wHeatFluid cp=HeatFluid TInlet 2 T 1 ðUA=ðwc Þ
dt e P HeatFluid Þ
88 Batch and Semi-batch Reactors
The time to heat the liquid inside the batch reactor is then
ðUA=wLiq cp=Liq Þ
VLiq ρLiq e THeatFluid 2 TInitial
ln 5t
wLiq eðUA=wLiq cp=Liq Þ 2 1 THeatFluid 2 TFinal
For analysis of more complex heating systems, see the open litera-
ture, which is rife with them.1(p628, chp 18)
If the kinetics for the chemical reaction are too complex to be reduced
to a manageable equation, then we can plot product concentration or
reactant concentration as a function of time and read the time required to
reach a specified concentration from the plot (see Chapter 2).
After completing the chemical reaction, we may need to cool the
liquid contents of the batch or semi-batch reactor before discharging
it. For a batch or semi-batch reactor equipped with internal coiled
loops or a jacket containing finished product at temperature TReaction,
the time to cool the liquid volume using an isothermal cooling fluid at
TCoolFluid is1
VProduct ρProduct cP=Product TReaction 2 TCoolFluid
t5 ln
UA TFinal 2 TCoolFluid
where all the other variables have been previously defined. For a simi-
lar process using a non-isothermal cooling fluid, the time to cool the
liquid volume inside the reactor is
ðUA=wCoolFluid cP=CoolFluid Þ
e VProduct ρProduct TCoolFluid 2TInitial
t5 ðUA=w ln
e CoolFluid cP=CoolFluid Þ 21 wCoolFluid cP=CoolFluid TCoolFluid 2TFinal
VFlushSolvent
t5
QFlushSolvent
The batch or semi-batch reactor requires drying after flushing its inte-
rior. If our reactor has a jacket, we dry it by applying steam to the jacket
and streaming either ambient or hot gas, generally air, through the reac-
tor’s interior. If the reactor does not possess a jacket, then we stream hot
gas through it.
1 dm
RDrying 5 2
A dt
where RDrying is the drying rate (kg/m2 s); A is the interior surface area
covered with liquid (m2); m is the liquid mass (kg); and t is the
time (s). When we plot RDrying as a function of time, we see it is a
composite function: at early time, RDrying is constant; at later times,
RDrying decreases linearly with time. Thus
RDrying 5 RConstantRate 1 RFallRate
where RConstantRate occurs when RDrying is constant and RFallRate occurs
when RDrying decreases with increasing time. Therefore, the total dry-
ing time will be
tT 5 tCR 1 tFR
where tT is the total drying time (s); tCR is the drying time during the
constant drying rate period (s); and tFR is the drying time during the
falling period rate (s).
where tFR is the drying time for the falling rate period (s); mC is the
weight of liquid inside the reactor when the liquid film becomes discon-
tinuous (kg); and mFinal is the final weight of liquid inside the reactor.
Performing the above integration gives
mFinal mC
kDrying A tFR 5 2ln 5 ln
mC mFinal
Rearranging the last equation yields
1 mC
tFR 5 ln
kDrying A mFinal
The total drying time is then
ðmInitial 2 mC Þ 1 mC
tT 5 1 ln
ARConstantRate kDrying A mFinal
where each t has units of h/batch. The above equation determines the
capacity of a particular batch or semi-batch reactor at a given produc-
tion facility.
A 1 B-P
the cost of reaction is
ðNPÞRxn 5 wP P 2 CRxn
Batch and Semi-Batch Operations 95
Subtracting all the other costs from (NP)Rxn gives the net profit for
the process; thus
ðNPÞProcess 5 wP P 2 CTotal
dðNPÞProcess dP
5 wP
dtRxn dtRxn
which gives
β 2 2 γt 1 3 δt2 1 ? 5 0
Solving the above equation for t provides the optimum tRxn for the
process.4
A3B
dnA
2 5 RA
dt
where RA is
RA 5 kF nA 2 kR nB
with kF being the forward rate constant (1/s); nA, the moles of reac-
tant A; kR, the reverse rate constant (1/s); and nB, the moles of product
B. At any given time
nB 5 nB=t50 1 nA=t50 2 nA
where nA/t50 and nB/t50 are the initial moles of reactant A and product
B in the batch reactor. Of course, at t 5 0, nB/t50 is zero; therefore, the
above equation becomes
nB 5 nA=t50 2 nA
Defining conversion as
nA=t50 2 nA nB
x5 5
nA=t50 nA=t50
then rearranging that definition in terms of nA and nB gives
nB 5 xnA=t50
nA 5 ð1 2 xÞnA=t50
Substituting the above definitions into the last equation for RA,
then rearranging yields
kF 5 AF e2ðEF =Rg TÞ
and
kR 5 AR e2ðER =Rg TÞ
where the subscript F references the forward reaction and the subscript R
references the reverse reaction; A is the “frequency factor” or “collision
parameter” for each respective reaction; E is the “activation energy” for
each respective reaction; Rg is the gas constant; and T is the operating
temperature. Differentiating each rate constant with respect to T yields
!
dkF EF 2ðEF =Rg TÞ
5 2AF e
dT Rg
!
dkR ER 2ðER =Rg TÞ
5 2AR e
dT Rg
ER 2 EF
TOptimum 5
Rg ln½ðAR ER =AF EF Þðx=ð1 2 xÞÞ
X 1 Y-P-BP
100 Batch and Semi-batch Reactors
where the symbols have been defined above. If EBP . EP, then a low, con-
tinuous operating temperature maximizes product yield, but at a slow
rate.5(p129) To maximize product formation rate, specifying a high initial
operating temperature permits the rapid accumulation of P; to conserve
that accumulated P, we decrease the operating temperature while continu-
ing to consume X and Y, which requires a reactor with an external cooler
capable of a high circulation rate.6(p382),8 If EP . EBP, then a high, contin-
uous operating temperature maximizes product yield.5(p129) The chemical
engineering literature abounds with many other such examples.9,10
SUMMARY
This chapter discussed process cycle time, which is the total time from
charging feed to a batch or semi-batch reactor to the next feed charge
of the same reactor, and its optimization. This chapter also discussed
the reaction time required to optimize the profitability of a given batch
or semi-batch reactor. It finished by presenting scenarios for maximiz-
ing product formation and quality through process temperature
optimization.
REFERENCES
1. Kern D. Process heat transfer. New York, NY: McGraw-Hill Book Company; 1950.
p. 626627.
2. Coker A. Modeling of chemical kinetics and reactor design. Boston, MA: Gulf Professional
Publishing; 2001. p. 637639.
3. McCabe W, Smith J. Unit operations of chemical engineering. 3rd ed. McGraw-Hill Book
Company; 1976. p. 785.
4. Aris R. The optimal design of chemical reactors. New York, NY: Academic Press; 1961.
5. Denbigh K. Chemical reactor theory: an introduction. Cambridge, UK: Cambridge
University Press; 1966. p. 126.
6. Froment G, Bischoff K. Chemical reactor analysis and design. New York, NY: John Wiley &
Sons, Inc.; 1979. p. 377.
7. Smith J. Chemical engineering kinetics. 3rd ed. New York, NY: McGraw-Hill Book
Company; 1983. p. 259.
8. Rase H. Chemical reactor design for process plants: volume 1—principles and techniques. New
York, NY: John Wiley & Sons, Inc.; 1977. p. 567569.
9. Fournier C, Groves F. Isothermal temperatures for reversible reactions. Chem Eng 1970;77
(3):1215.
10. Fournier C, Groves F. Rapid method for calculating reactor temperature profiles. Chem Eng
1970;77(13):1579.