Mixture of Acetic acid, butyl ester + Cyclohexane + Water

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

Cyclohexane

Name
Cyclohexane
InChI
InChI=1S/C6H12/c1-2-4-6-5-3-1/h1-6H2
InChI Key
XDTMQSROBMDMFD-UHFFFAOYSA-N
Formula
C6H12
SMILES
C1CCCCC1
Mol. Weight (g/mol)
84.16
CAS
110-82-7

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
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Datasets

  1. Tboil(P) - Boiling temperature at pressure P, K
  2. Vapor Liquid Equilibrium at Constant Pressure (3)

Boiling temperature at pressure P, K [ref]

Fixed Measured
Pressure, kPa - Liquid Mole fraction of Water (3) - Liquid Mole fraction of Acetic acid, butyl ester (1) - Liquid Boiling temperature at pressure P, K - Liquid
29.77 0.2080 0.5310 321.75
29.77 0.2290 0.4517 320.15
29.77 0.2419 0.4771 321.05
29.77 0.2747 0.4862 321.95
29.77 0.2790 0.1247 315.25
29.77 0.8035 0.0000 311.35
29.77 0.8156 0.0926 317.80
29.77 0.8408 0.0645 316.50
29.77 0.8564 0.1045 322.55
29.77 0.8678 0.1059 325.25
29.77 0.8728 0.0289 314.55
29.77 0.8789 0.1073 329.35
58.85 0.2080 0.5310 339.45
58.85 0.2290 0.4517 337.45
58.85 0.2419 0.4771 337.85
58.85 0.2747 0.4862 339.45
58.85 0.2790 0.1247 330.75
58.85 0.8035 0.0000 328.15
58.85 0.8156 0.0926 335.15
58.85 0.8408 0.0645 333.65
58.85 0.8564 0.1045 339.65
58.85 0.8678 0.1059 341.45
58.85 0.8728 0.0289 331.55
58.85 0.8789 0.1073 345.05
87.65 0.2080 0.5310 350.85
87.65 0.2290 0.4517 348.55
87.65 0.2419 0.4771 349.25
87.65 0.2747 0.4862 350.65
87.65 0.2790 0.1247 341.05
87.65 0.8035 0.0000 338.80
87.65 0.8156 0.0926 345.95
87.65 0.8408 0.0645 344.45
87.65 0.8564 0.1045 350.35
87.65 0.8678 0.1059 351.65
87.65 0.8728 0.0289 342.45
87.65 0.8789 0.1073 354.95

Vapor Liquid Equilibrium at Constant Pressure [ref]

Operational condition: Pressure, kPa = 29.77 (VLE)

Fixed Measured
T [K] - VLE x1[mol/mol] of Water (3) - Liquid x2[mol/mol] of Acetic acid, butyl ester (1) - Liquid
314.55 0.8728 0.0289
316.5 0.8408 0.0645
317.8 0.8156 0.0926
329.35 0.8789 0.1073
325.25 0.8678 0.1059
322.55 0.8564 0.1045
321.05 0.2419 0.4771
320.15 0.2290 0.4517
315.25 0.2790 0.1247
321.75 0.2080 0.5310
321.95 0.2747 0.4862
311.35 0.8035 0.0000

Vapor Liquid Equilibrium at Constant Pressure [ref]

Operational condition: Pressure, kPa = 58.85 (VLE)

Fixed Measured
T [K] - VLE x1[mol/mol] of Water (3) - Liquid x2[mol/mol] of Acetic acid, butyl ester (1) - Liquid
331.55 0.8728 0.0289
333.65 0.8408 0.0645
335.15 0.8156 0.0926
345.05 0.8789 0.1073
341.45 0.8678 0.1059
339.65 0.8564 0.1045
337.85 0.2419 0.4771
337.45 0.2290 0.4517
330.75 0.2790 0.1247
339.45 0.2080 0.5310
339.45 0.2747 0.4862
328.15 0.8035 0.0000

Vapor Liquid Equilibrium at Constant Pressure [ref]

Operational condition: Pressure, kPa = 87.65 (VLE)

Fixed Measured
T [K] - VLE x1[mol/mol] of Water (3) - Liquid x2[mol/mol] of Acetic acid, butyl ester (1) - Liquid
342.45 0.8728 0.0289
344.45 0.8408 0.0645
345.95 0.8156 0.0926
354.95 0.8789 0.1073
351.65 0.8678 0.1059
350.35 0.8564 0.1045
349.25 0.2419 0.4771
348.55 0.2290 0.4517
341.05 0.2790 0.1247
350.85 0.2080 0.5310
350.65 0.2747 0.4862
338.8 0.8035 0.0000

Sources

Note: These property values are available through the Cheméo API. A free account gives you an access key.