Mixture of Hexanoic acid, ethyl ester + Ethanol + Water

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Hexanoic acid, ethyl ester

Name
Hexanoic acid, ethyl ester
InChI
InChI=1S/C8H16O2/c1-3-5-6-7-8(9)10-4-2/h3-7H2,1-2H3
InChI Key
SHZIWNPUGXLXDT-UHFFFAOYSA-N
Formula
C8H16O2
SMILES
CCCCCC(=O)OCC
Mol. Weight (g/mol)
144.21
CAS
123-66-0

Ethanol

Name
Ethanol
InChI
InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3
InChI Key
LFQSCWFLJHTTHZ-UHFFFAOYSA-N
Formula
C2H6O
SMILES
CCO
Mol. Weight (g/mol)
46.07
CAS
64-17-5

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. Temperature, K x Mole fraction (2)

Temperature, K x Mole fraction [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid mixture 1)

Fixed Measured
Temperature, K - Liquid mixture 1 Mole fraction of Water (3) - Liquid mixture 1 Mole fraction of Ethanol (2) - Liquid mixture 1 Mole fraction of Ethanol (2) - Liquid mixture 2 Mole fraction of Water (3) - Liquid mixture 2
283.15 0.0227 0.0000 0.0000 0.9999
283.15 0.0405 0.0845 0.0668 0.9326
283.15 0.0745 0.1914 0.1135 0.8854
283.15 0.1192 0.2654 0.1423 0.8560
283.15 0.1708 0.3395 0.1759 0.8210
283.15 0.2155 0.3770 0.1988 0.7964
283.15 0.2787 0.4035 0.2153 0.7768
283.15 0.3497 0.4167 0.2457 0.7388
283.15 0.4355 0.4131 0.2798 0.7012
308.15 0.0548 0.0000 0.0000 0.9999
308.15 0.0619 0.0713 0.0325 0.9666
308.15 0.1035 0.1778 0.0753 0.9235
308.15 0.1504 0.2818 0.1100 0.8887
308.15 0.2133 0.3490 0.1464 0.8492
308.15 0.2621 0.3806 0.1679 0.8244
308.15 0.3104 0.3994 0.1976 0.7911
308.15 0.3824 0.4057 0.2313 0.7446
308.15 0.4709 0.3935 0.2870 0.6784
323.15 0.0630 0.0000 0.0000 1.0000
323.15 0.0752 0.0834 0.0406 0.9592
323.15 0.1061 0.1711 0.0914 0.9080
323.15 0.1354 0.2294 0.1167 0.8822
323.15 0.1664 0.3000 0.1419 0.8563
323.15 0.2121 0.3515 0.1670 0.8297
323.15 0.2699 0.3790 0.1817 0.8124
323.15 0.3383 0.3932 0.2052 0.7863
323.15 0.3929 0.3935 0.2323 0.7488
323.15 0.4839 0.3727 0.2586 0.7140

Temperature, K x Mole fraction [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid mixture 1)

Fixed Measured
Temperature, K - Liquid mixture 1 Mole fraction of Water (3) - Liquid mixture 1 Mole fraction of Ethanol (2) - Liquid mixture 1 Mole fraction of Ethanol (2) - Liquid mixture 2 Mole fraction of Water (3) - Liquid mixture 2
283.15 0.0227 0.0000 0.0000 0.9999
283.15 0.0405 0.0845 0.0668 0.9326
283.15 0.0745 0.1914 0.1135 0.8854
283.15 0.1192 0.2654 0.1423 0.8560
283.15 0.1708 0.3395 0.1759 0.8210
283.15 0.2155 0.3770 0.1988 0.7964
283.15 0.2787 0.4035 0.2153 0.7768
283.15 0.3497 0.4167 0.2457 0.7388
283.15 0.4355 0.4131 0.2798 0.7012
308.15 0.0548 0.0000 0.0000 0.9999
308.15 0.0619 0.0713 0.0325 0.9666
308.15 0.1035 0.1778 0.0753 0.9235
308.15 0.1504 0.2818 0.1100 0.8887
308.15 0.2133 0.3490 0.1464 0.8492
308.15 0.2621 0.3806 0.1679 0.8244
308.15 0.3104 0.3994 0.1976 0.7911
308.15 0.3824 0.4057 0.2313 0.7446
308.15 0.4709 0.3935 0.2870 0.6784
323.15 0.0630 0.0000 0.0000 1.0000
323.15 0.0752 0.0834 0.0406 0.9592
323.15 0.1061 0.1711 0.0914 0.9080
323.15 0.1354 0.2294 0.1167 0.8822
323.15 0.1664 0.3000 0.1419 0.8563
323.15 0.2121 0.3515 0.1670 0.8297
323.15 0.2699 0.3790 0.1817 0.8124
323.15 0.3383 0.3932 0.2052 0.7863
323.15 0.3929 0.3935 0.2323 0.7488
323.15 0.4839 0.3727 0.2586 0.7140

Sources