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Calculation For 80 Ml/min, First Data: Sample Calculation Conversion Calculation

The document provides calculations and analysis for determining the order and rate constant of a chemical reaction. Graphs are plotted of conversion versus time or concentration to determine if the reaction is zero order, first order, or second order. The reaction is determined to be second order based on the linearity of plots.

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Resky Ervaldi Saputra
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64 views

Calculation For 80 Ml/min, First Data: Sample Calculation Conversion Calculation

The document provides calculations and analysis for determining the order and rate constant of a chemical reaction. Graphs are plotted of conversion versus time or concentration to determine if the reaction is zero order, first order, or second order. The reaction is determined to be second order based on the linearity of plots.

Uploaded by

Resky Ervaldi Saputra
Copyright
© © All Rights Reserved
We take content rights seriously. If you suspect this is your content, claim it here.
Available Formats
Download as DOCX, PDF, TXT or read online on Scribd
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Sample Calculation

Conversion Calculation

Calculation for 80 ml/min, first data

M NaOH V NaOH =M HClV HCl

0.1 (mmol/ml) * 4.8 ml = 0.10 (mmol/ml) * V HCl

V HCl =4.8 ml (Excess HCl)

V HCl inlet V HCl excess =10 ( ml ) 4.8( ml)

V HClconsumed sample= 5.2 (ml)

Mol of reacted HCL=V HClconsumed sampleInitial HCL Concentration

Mol of reacted HCL=5.20.1=0.52 mol

Mol of unreacted NaOH =Mol of reacted HCL=0.52 mol

mol of unreacted NaOH 0.52


Concentration of unreacted NaOH = = =0.052 M
Volume of Sample 10

Concentration of unreacted NaOH


Conversion= 1 ( Intial concentration of NaOH )
x 100 =48

Order and Rate Constant Calculation

Zero order assumption

r A=k
XA
dx A
t=CaO
0
k

t x
= A
Ca O k

Plotted XA vs t/CaO , inverse slope gives k,


t (min) XA t/Cao
10 0.48 100
11.42857 0.5 114.2857
16 0.58 160
20 0.61 200

zero order
250

200
f(x) = 718.87x - 246.42
R = 0.97
150
X

100

50

0
0.46 0.48 0.5 0.52 0.54 0.56 0.58 0.6 0.62
t/Cao

first order assumption,

r A=kCao ( 1 X )
XA
dx A
t=CaO
0 kCao(1 X)

ln( ( 1 X ))
1
t=
k

Plot t vs -Ln(1-X), inverse slope gives k.

t X -Ln(1-X)
10 0.48 0.65392
6
11.42857 0.5 0.69314
7
16 0.58 0.86750
1
20 0.61 0.94160
9

First oder
1
0.9 f(x) = 0.03x + 0.36
0.8 R = 0.98
0.7
0.6
0.5
t

0.4
0.3
0.2
0.1
0
8 10 12 14 16 18 20 22
-Ln(1-X)

Second Order Assumption

r A=kCao2 ( 1X )2
XA
dX
t=Cao
0 kCao2(1X )2

1
X
kCao
t=
(1 X)2

Plot t*Cao vs X/(1-X)2, inverse slope gives k,

Xt*Cao X/(1-X)^2
1 1.77514792
9
1.1428571 2
43
1.6 3.28798185
9
2 4.01051939
5
Second order
2.5

2
f(x) = 0.43x + 0.26
R = 0.99
1.5
t*Cao

0.5

0
1.5 2 2.5 3 3.5 4 4.5
X/(1-X)^2

Since second order assumption gives more linearity than other orders. It suits with the literature
that second order is applied for this saponification reaction

Slope = 0.426

k=1 / Slope = 2.35 mL/(mmol.min)

Rate = k * Ca02*(1-X)2

XFlowrate(ml/min) Ca Conversion Rate (mmol/


(mmol/mL) (mL*min))
80 0.052 0.48 0.006347418
70 0.05 0.5 0.005868545
50 0.042 0.58 0.004140845
40 0.039 0.61 0.003570423

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