Mixture of 1,2-Benzenediol + Acetic acid, butyl ester + Water

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1,2-Benzenediol

Name
1,2-Benzenediol
InChI
InChI=1S/C6H6O2/c7-5-3-1-2-4-6(5)8/h1-4,7-8H
InChI Key
YCIMNLLNPGFGHC-UHFFFAOYSA-N
Formula
C6H6O2
SMILES
Oc1ccccc1O
Mol. Weight (g/mol)
110.11
CAS
120-80-9

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

Datasets

Temperature, K x Mass fraction [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 2 Mass fraction of Acetic acid, butyl ester (2) - Liquid mixture 1 Mass fraction of 1,2-Benzenediol (1) - Liquid mixture 1 Mass fraction of Acetic acid, butyl ester (2) - Liquid mixture 2 Mass fraction of 1,2-Benzenediol (1) - Liquid mixture 2
298.15 0.9016 0.0840 0.0092 0.0033
318.15 0.9133 0.0620 0.0063 0.0040
318.15 0.8179 0.1511 0.0086 0.0160
298.15 0.4436 0.4021 0.0119 0.1276
298.15 0.2824 0.4613 0.0249 0.2040
318.15 0.5318 0.3747 0.0100 0.1126
318.15 0.4735 0.3972 0.0126 0.1419
318.15 0.2811 0.4184 0.0360 0.2336
318.15 0.4151 0.4121 0.0191 0.1724
298.15 0.7492 0.2011 0.0083 0.0214
318.15 0.3597 0.4218 0.0304 0.1971
308.15 0.6523 0.2853 0.0071 0.0442
308.15 0.5897 0.3310 0.0078 0.0781
298.15 0.6820 0.2597 0.0072 0.0350
298.15 0.6602 0.2744 0.0074 0.0385
298.15 0.3621 0.4450 0.0135 0.1881
298.15 0.6197 0.3096 0.0081 0.0557
298.15 0.2412 0.4580 0.0317 0.2303
298.15 0.5359 0.3688 0.0086 0.0836
318.15 0.6874 0.2589 0.0079 0.0423
308.15 0.8954 0.0753 0.0063 0.0033
308.15 0.8147 0.1524 0.0072 0.0132
308.15 0.6024 0.3235 0.0084 0.0684
308.15 0.7544 0.2031 0.0081 0.0229
308.15 0.5153 0.3845 0.0093 0.1095
308.15 0.7011 0.2439 0.0070 0.0381
318.15 0.3193 0.4219 0.0316 0.2138
298.15 0.7996 0.1573 0.0076 0.0116
308.15 0.4638 0.4068 0.0112 0.1320
308.15 0.3933 0.4255 0.0148 0.1597
318.15 0.6631 0.2747 0.0080 0.0516
308.15 0.3532 0.4284 0.0236 0.1842

Temperature, K x Mass fraction [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 2 Mass fraction of Acetic acid, butyl ester (2) - Liquid mixture 1 Mass fraction of 1,2-Benzenediol (1) - Liquid mixture 1 Mass fraction of Acetic acid, butyl ester (2) - Liquid mixture 2 Mass fraction of 1,2-Benzenediol (1) - Liquid mixture 2
298.15 0.9016 0.0840 0.0092 0.0033
318.15 0.9133 0.0620 0.0063 0.0040
318.15 0.8179 0.1511 0.0086 0.0160
298.15 0.4436 0.4021 0.0119 0.1276
298.15 0.2824 0.4613 0.0249 0.2040
318.15 0.5318 0.3747 0.0100 0.1126
318.15 0.4735 0.3972 0.0126 0.1419
318.15 0.2811 0.4184 0.0360 0.2336
318.15 0.4151 0.4121 0.0191 0.1724
298.15 0.7492 0.2011 0.0083 0.0214
318.15 0.3597 0.4218 0.0304 0.1971
308.15 0.6523 0.2853 0.0071 0.0442
308.15 0.5897 0.3310 0.0078 0.0781
298.15 0.6820 0.2597 0.0072 0.0350
298.15 0.6602 0.2744 0.0074 0.0385
298.15 0.3621 0.4450 0.0135 0.1881
298.15 0.6197 0.3096 0.0081 0.0557
298.15 0.2412 0.4580 0.0317 0.2303
298.15 0.5359 0.3688 0.0086 0.0836
318.15 0.6874 0.2589 0.0079 0.0423
308.15 0.8954 0.0753 0.0063 0.0033
308.15 0.8147 0.1524 0.0072 0.0132
308.15 0.6024 0.3235 0.0084 0.0684
308.15 0.7544 0.2031 0.0081 0.0229
308.15 0.5153 0.3845 0.0093 0.1095
308.15 0.7011 0.2439 0.0070 0.0381
318.15 0.3193 0.4219 0.0316 0.2138
298.15 0.7996 0.1573 0.0076 0.0116
308.15 0.4638 0.4068 0.0112 0.1320
308.15 0.3933 0.4255 0.0148 0.1597
318.15 0.6631 0.2747 0.0080 0.0516
308.15 0.3532 0.4284 0.0236 0.1842

Temperature, K x Mass fraction [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 2 Mass fraction of Acetic acid, butyl ester (2) - Liquid mixture 1 Mass fraction of 1,2-Benzenediol (1) - Liquid mixture 1 Mass fraction of Acetic acid, butyl ester (2) - Liquid mixture 2 Mass fraction of 1,2-Benzenediol (1) - Liquid mixture 2
298.15 0.9016 0.0840 0.0092 0.0033
318.15 0.9133 0.0620 0.0063 0.0040
318.15 0.8179 0.1511 0.0086 0.0160
298.15 0.4436 0.4021 0.0119 0.1276
298.15 0.2824 0.4613 0.0249 0.2040
318.15 0.5318 0.3747 0.0100 0.1126
318.15 0.4735 0.3972 0.0126 0.1419
318.15 0.2811 0.4184 0.0360 0.2336
318.15 0.4151 0.4121 0.0191 0.1724
298.15 0.7492 0.2011 0.0083 0.0214
318.15 0.3597 0.4218 0.0304 0.1971
308.15 0.6523 0.2853 0.0071 0.0442
308.15 0.5897 0.3310 0.0078 0.0781
298.15 0.6820 0.2597 0.0072 0.0350
298.15 0.6602 0.2744 0.0074 0.0385
298.15 0.3621 0.4450 0.0135 0.1881
298.15 0.6197 0.3096 0.0081 0.0557
298.15 0.2412 0.4580 0.0317 0.2303
298.15 0.5359 0.3688 0.0086 0.0836
318.15 0.6874 0.2589 0.0079 0.0423
308.15 0.8954 0.0753 0.0063 0.0033
308.15 0.8147 0.1524 0.0072 0.0132
308.15 0.6024 0.3235 0.0084 0.0684
308.15 0.7544 0.2031 0.0081 0.0229
308.15 0.5153 0.3845 0.0093 0.1095
308.15 0.7011 0.2439 0.0070 0.0381
318.15 0.3193 0.4219 0.0316 0.2138
298.15 0.7996 0.1573 0.0076 0.0116
308.15 0.4638 0.4068 0.0112 0.1320
308.15 0.3933 0.4255 0.0148 0.1597
318.15 0.6631 0.2747 0.0080 0.0516
308.15 0.3532 0.4284 0.0236 0.1842

Temperature, K x Mass fraction [ref]

Operational condition: Pressure, kPa = 101.3 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 2 Mass fraction of Acetic acid, butyl ester (2) - Liquid mixture 1 Mass fraction of 1,2-Benzenediol (1) - Liquid mixture 1 Mass fraction of Acetic acid, butyl ester (2) - Liquid mixture 2 Mass fraction of 1,2-Benzenediol (1) - Liquid mixture 2
298.15 0.9016 0.0840 0.0092 0.0033
318.15 0.9133 0.0620 0.0063 0.0040
318.15 0.8179 0.1511 0.0086 0.0160
298.15 0.4436 0.4021 0.0119 0.1276
298.15 0.2824 0.4613 0.0249 0.2040
318.15 0.5318 0.3747 0.0100 0.1126
318.15 0.4735 0.3972 0.0126 0.1419
318.15 0.2811 0.4184 0.0360 0.2336
318.15 0.4151 0.4121 0.0191 0.1724
298.15 0.7492 0.2011 0.0083 0.0214
318.15 0.3597 0.4218 0.0304 0.1971
308.15 0.6523 0.2853 0.0071 0.0442
308.15 0.5897 0.3310 0.0078 0.0781
298.15 0.6820 0.2597 0.0072 0.0350
298.15 0.6602 0.2744 0.0074 0.0385
298.15 0.3621 0.4450 0.0135 0.1881
298.15 0.6197 0.3096 0.0081 0.0557
298.15 0.2412 0.4580 0.0317 0.2303
298.15 0.5359 0.3688 0.0086 0.0836
318.15 0.6874 0.2589 0.0079 0.0423
308.15 0.8954 0.0753 0.0063 0.0033
308.15 0.8147 0.1524 0.0072 0.0132
308.15 0.6024 0.3235 0.0084 0.0684
308.15 0.7544 0.2031 0.0081 0.0229
308.15 0.5153 0.3845 0.0093 0.1095
308.15 0.7011 0.2439 0.0070 0.0381
318.15 0.3193 0.4219 0.0316 0.2138
298.15 0.7996 0.1573 0.0076 0.0116
308.15 0.4638 0.4068 0.0112 0.1320
308.15 0.3933 0.4255 0.0148 0.1597
318.15 0.6631 0.2747 0.0080 0.0516
308.15 0.3532 0.4284 0.0236 0.1842

Sources

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