Mixture of Benzene + Acetic acid, butyl ester + Water

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Benzene

Name
Benzene
InChI
InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H
InChI Key
UHOVQNZJYSORNB-UHFFFAOYSA-N
Formula
C6H6
SMILES
c1ccccc1
Mol. Weight (g/mol)
78.11
CAS
71-43-2

Acetic acid, butyl ester

Name
Acetic acid, butyl ester
InChI
InChI=1S/C6H12O2/c1-3-4-5-8-6(2)7/h3-5H2,1-2H3
InChI Key
DKPFZGUDAPQIHT-UHFFFAOYSA-N
Formula
C6H12O2
SMILES
CCCCOC(C)=O
Mol. Weight (g/mol)
116.16
CAS
123-86-4

Water

Name
Water
InChI
InChI=1S/H2O/h1H2
InChI Key
XLYOFNOQVPJJNP-UHFFFAOYSA-N
Formula
H2O
SMILES
O
Mol. Weight (g/mol)
18.02
CAS
7732-18-5
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Datasets

  1. Vapor Liquid Equilibrium at Constant Pressure

Vapor Liquid Equilibrium at Constant Pressure [ref]

Operational condition: Pressure, kPa = 101.33 (VLE)

Fixed Measured
T [K] - VLE x1[mol/mol] of Benzene (1) - Liquid x2[mol/mol] of Acetic acid, butyl ester (2) - Liquid y1[mol/mol] of Benzene (1) - Vapour y2[mol/mol] of Acetic acid, butyl ester (2) - Vapour
353.25 1.0000 0.0000 1.0000 0.0000
399.25 0.0000 1.0000 0.0000 1.0000
349.15 0.7500 0.2000 0.7080 0.0200
349.95 0.5450 0.3650 0.5980 0.0610
352.75 0.4000 0.4750 0.4370 0.0810
358.15 0.2000 0.6400 0.2880 0.1440
349.05 0.8000 0.1200 0.6660 0.0120
347.75 0.6000 0.2400 0.5860 0.0320
349.75 0.4730 0.3150 0.5110 0.0530
354.95 0.2500 0.4500 0.3730 0.1130
344.75 0.8000 0.0780 0.6850 0.0070
346.05 0.6000 0.1600 0.6000 0.0270
349.75 0.3700 0.2500 0.5100 0.0570
354.25 0.2000 0.3200 0.3960 0.1080
343.45 0.8000 0.0380 0.6560 0.0040
344.25 0.6000 0.0750 0.6670 0.0140
346.25 0.4000 0.1150 0.6330 0.0270
349.75 0.2250 0.1500 0.5200 0.0590

Sources