Mixture of Isopropyl Alcohol + Isopropyl acetate + Water

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Isopropyl Alcohol

Name
Isopropyl Alcohol
InChI
InChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3
InChI Key
KFZMGEQAYNKOFK-UHFFFAOYSA-N
Formula
C3H8O
SMILES
CC(C)O
Mol. Weight (g/mol)
60.09
CAS
67-63-0

Isopropyl acetate

Name
Isopropyl acetate
InChI
InChI=1S/C5H10O2/c1-4(2)7-5(3)6/h4H,1-3H3
InChI Key
JMMWKPVZQRWMSS-UHFFFAOYSA-N
Formula
C5H10O2
SMILES
CC(=O)OC(C)C
Mol. Weight (g/mol)
102.13
CAS
108-21-4

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. Temperature, K x Mole fraction (8)
  2. Azeotropic temperature, K (2)

Temperature, K x Mole fraction [ref]

Operational condition: Pressure, kPa = 101 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 1 Mole fraction of Isopropyl Alcohol (1) - Liquid mixture 2 Mole fraction of Water (3) - Liquid mixture 2 Mole fraction of Isopropyl Alcohol (1) - Liquid mixture 1 Mole fraction of Water (3) - Liquid mixture 1 Mole fraction of Isopropyl Alcohol (1) - Gas Mole fraction of Water (3) - Gas
350.40 0.1007 0.8889 0.2910 0.5365 0.1900 0.3783
350.30 0.0725 0.9127 0.2742 0.4821 0.1810 0.3803
350.20 0.0613 0.9229 0.2517 0.4352 0.1688 0.3864
350.00 0.0557 0.9258 0.2295 0.4024 0.1565 0.3873
349.90 0.0557 0.9306 0.2070 0.3652 0.1412 0.3922
349.80 0.0500 0.9334 0.1845 0.3355 0.1320 0.3943
349.60 0.0444 0.9509 0.1623 0.2981 0.1229 0.3935
349.40 0.0332 0.9542 0.1397 0.2850 0.1166 0.3940
349.30 0.0278 0.9543 0.1274 0.2702 0.0983 0.3954
349.20 0.0278 0.9663 0.1060 0.2632 0.0922 0.4010
349.10 0.0222 0.9740 0.0894 0.2373 0.0830 0.3990
348.90 0.0136 0.9760 0.0557 0.2350 0.0585 0.4059
348.80 0.0166 0.9768 0.0278 0.2245 0.0341 0.4101
348.60 0.0053 0.9776 0.0110 0.2184 0.0188 0.4112

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 Water (3) - Liquid mixture 1 Mass fraction of Isopropyl acetate (2) - Liquid mixture 1 Mass fraction of Water (3) - Liquid mixture 2 Mass fraction of Isopropyl acetate (2) - Liquid mixture 2
298.15 0.9729 0.0271 0.0168 0.9832
298.15 0.9402 0.0328 0.0397 0.9395
298.15 0.9165 0.0337 0.0515 0.9047
298.15 0.8937 0.0341 0.0576 0.8735
298.15 0.8607 0.0371 0.0629 0.8151
298.15 0.8466 0.0392 0.0673 0.7848
298.15 0.8355 0.0384 0.0757 0.7511
298.15 0.8242 0.0380 0.0846 0.7180
298.15 0.8134 0.0394 0.0963 0.6842
303.15 0.9742 0.0258 0.0176 0.9824
303.15 0.9255 0.0480 0.0291 0.9464
303.15 0.9043 0.0462 0.0322 0.9175
303.15 0.8870 0.0439 0.0402 0.8832
303.15 0.8656 0.0492 0.0529 0.8428
303.15 0.8542 0.0462 0.0611 0.8067
303.15 0.8387 0.0505 0.0734 0.7681
303.15 0.8309 0.0470 0.0856 0.7294
303.15 0.8112 0.0488 0.1110 0.6573
308.15 0.9767 0.0233 0.0209 0.9791
308.15 0.9436 0.0324 0.0253 0.9518
308.15 0.9151 0.0412 0.0378 0.9135
308.15 0.8971 0.0415 0.0469 0.8779
308.15 0.8573 0.0413 0.0742 0.7721
308.15 0.8448 0.0426 0.0828 0.7374
308.15 0.8404 0.0384 0.0909 0.7043
308.15 0.8252 0.0436 0.1058 0.6674
308.15 0.8129 0.0480 0.1151 0.6378
313.15 0.9779 0.0221 0.0228 0.9772
313.15 0.9303 0.0470 0.0324 0.9407
313.15 0.9067 0.0502 0.0408 0.9039
313.15 0.8891 0.0502 0.0541 0.8617
313.15 0.8699 0.0540 0.0623 0.8241
313.15 0.8555 0.0554 0.0765 0.7805
313.15 0.8474 0.0519 0.0895 0.7398
313.15 0.8314 0.0572 0.1043 0.6985
313.15 0.8188 0.0601 0.1205 0.6578
318.15 0.9782 0.0218 0.0232 0.9768
318.15 0.9353 0.0432 0.0294 0.9438
318.15 0.9161 0.0431 0.0353 0.9099
318.15 0.8780 0.0496 0.0495 0.8280
318.15 0.8635 0.0523 0.0634 0.7951
318.15 0.8541 0.0504 0.0779 0.7534
318.15 0.8452 0.0491 0.0873 0.7180
318.15 0.8375 0.0483 0.0993 0.6818
318.15 0.8232 0.0535 0.1119 0.6472
323.15 0.9789 0.0211 0.0254 0.9746
323.15 0.9407 0.0369 0.0367 0.9331
323.15 0.9150 0.0420 0.0448 0.8966
323.15 0.8928 0.0454 0.0506 0.8624
323.15 0.8781 0.0491 0.0576 0.8243
323.15 0.8647 0.0499 0.0684 0.7904
323.15 0.8329 0.0533 0.0852 0.7401
323.15 0.8226 0.0533 0.0922 0.7071
323.15 0.8085 0.0593 0.1106 0.6629

Mole fraction of Isopropyl Alcohol (1) [ref]

Operational conditions:

Mole fraction of Isopropyl acetate (2) - Liquid mixture 1 Mole fraction of Isopropyl Alcohol (1) - Liquid mixture 1
0.0052 0.0430
0.0161 0.0869
0.0259 0.1055
0.0359 0.1192
0.0459 0.1335
0.0616 0.1546
0.0777 0.1730
0.1040 0.1997
0.0963 0.1923
0.1284 0.2180
0.1905 0.2498
0.2753 0.2588

Mole fraction [ref]

Operational conditions:

Fixed Measured
Mole fraction of Isopropyl Alcohol (1) - Liquid mixture 2 Mole fraction of Isopropyl acetate (2) - Liquid mixture 2 Mole fraction of Isopropyl Alcohol (1) - Liquid mixture 1 Mole fraction of Isopropyl acetate (2) - Liquid mixture 1
0.0000 0.0031 0.0000 0.8822
0.0157 0.0031 0.1044 0.7072
0.0327 0.0035 0.1940 0.5456
0.0320 0.0042 0.2161 0.4881
0.0396 0.0056 0.2364 0.4070
0.0446 0.0058 0.2363 0.3270

Temperature, K x Mole fraction [ref]

Operational condition: Pressure, kPa = 101 (Liquid mixture 2)

Fixed Measured
Temperature, K - Liquid mixture 1 Mole fraction of Isopropyl Alcohol (1) - Liquid mixture 2 Mole fraction of Water (3) - Liquid mixture 2 Mole fraction of Isopropyl Alcohol (1) - Liquid mixture 1 Mole fraction of Water (3) - Liquid mixture 1 Mole fraction of Isopropyl Alcohol (1) - Gas Mole fraction of Water (3) - Gas
350.40 0.1007 0.8889 0.2910 0.5365 0.1900 0.3783
350.30 0.0725 0.9127 0.2742 0.4821 0.1810 0.3803
350.20 0.0613 0.9229 0.2517 0.4352 0.1688 0.3864
350.00 0.0557 0.9258 0.2295 0.4024 0.1565 0.3873
349.90 0.0557 0.9306 0.2070 0.3652 0.1412 0.3922
349.80 0.0500 0.9334 0.1845 0.3355 0.1320 0.3943
349.60 0.0444 0.9509 0.1623 0.2981 0.1229 0.3935
349.40 0.0332 0.9542 0.1397 0.2850 0.1166 0.3940
349.30 0.0278 0.9543 0.1274 0.2702 0.0983 0.3954
349.20 0.0278 0.9663 0.1060 0.2632 0.0922 0.4010
349.10 0.0222 0.9740 0.0894 0.2373 0.0830 0.3990
348.90 0.0136 0.9760 0.0557 0.2350 0.0585 0.4059
348.80 0.0166 0.9768 0.0278 0.2245 0.0341 0.4101
348.60 0.0053 0.9776 0.0110 0.2184 0.0188 0.4112

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 Water (3) - Liquid mixture 1 Mass fraction of Isopropyl acetate (2) - Liquid mixture 1 Mass fraction of Water (3) - Liquid mixture 2 Mass fraction of Isopropyl acetate (2) - Liquid mixture 2
298.15 0.9729 0.0271 0.0168 0.9832
298.15 0.9402 0.0328 0.0397 0.9395
298.15 0.9165 0.0337 0.0515 0.9047
298.15 0.8937 0.0341 0.0576 0.8735
298.15 0.8607 0.0371 0.0629 0.8151
298.15 0.8466 0.0392 0.0673 0.7848
298.15 0.8355 0.0384 0.0757 0.7511
298.15 0.8242 0.0380 0.0846 0.7180
298.15 0.8134 0.0394 0.0963 0.6842
303.15 0.9742 0.0258 0.0176 0.9824
303.15 0.9255 0.0480 0.0291 0.9464
303.15 0.9043 0.0462 0.0322 0.9175
303.15 0.8870 0.0439 0.0402 0.8832
303.15 0.8656 0.0492 0.0529 0.8428
303.15 0.8542 0.0462 0.0611 0.8067
303.15 0.8387 0.0505 0.0734 0.7681
303.15 0.8309 0.0470 0.0856 0.7294
303.15 0.8112 0.0488 0.1110 0.6573
308.15 0.9767 0.0233 0.0209 0.9791
308.15 0.9436 0.0324 0.0253 0.9518
308.15 0.9151 0.0412 0.0378 0.9135
308.15 0.8971 0.0415 0.0469 0.8779
308.15 0.8573 0.0413 0.0742 0.7721
308.15 0.8448 0.0426 0.0828 0.7374
308.15 0.8404 0.0384 0.0909 0.7043
308.15 0.8252 0.0436 0.1058 0.6674
308.15 0.8129 0.0480 0.1151 0.6378
313.15 0.9779 0.0221 0.0228 0.9772
313.15 0.9303 0.0470 0.0324 0.9407
313.15 0.9067 0.0502 0.0408 0.9039
313.15 0.8891 0.0502 0.0541 0.8617
313.15 0.8699 0.0540 0.0623 0.8241
313.15 0.8555 0.0554 0.0765 0.7805
313.15 0.8474 0.0519 0.0895 0.7398
313.15 0.8314 0.0572 0.1043 0.6985
313.15 0.8188 0.0601 0.1205 0.6578
318.15 0.9782 0.0218 0.0232 0.9768
318.15 0.9353 0.0432 0.0294 0.9438
318.15 0.9161 0.0431 0.0353 0.9099
318.15 0.8780 0.0496 0.0495 0.8280
318.15 0.8635 0.0523 0.0634 0.7951
318.15 0.8541 0.0504 0.0779 0.7534
318.15 0.8452 0.0491 0.0873 0.7180
318.15 0.8375 0.0483 0.0993 0.6818
318.15 0.8232 0.0535 0.1119 0.6472
323.15 0.9789 0.0211 0.0254 0.9746
323.15 0.9407 0.0369 0.0367 0.9331
323.15 0.9150 0.0420 0.0448 0.8966
323.15 0.8928 0.0454 0.0506 0.8624
323.15 0.8781 0.0491 0.0576 0.8243
323.15 0.8647 0.0499 0.0684 0.7904
323.15 0.8329 0.0533 0.0852 0.7401
323.15 0.8226 0.0533 0.0922 0.7071
323.15 0.8085 0.0593 0.1106 0.6629

Mole fraction of Isopropyl Alcohol (1) [ref]

Operational conditions:

Mole fraction of Isopropyl acetate (2) - Liquid mixture 1 Mole fraction of Isopropyl Alcohol (1) - Liquid mixture 1
0.0052 0.0430
0.0161 0.0869
0.0259 0.1055
0.0359 0.1192
0.0459 0.1335
0.0616 0.1546
0.0777 0.1730
0.1040 0.1997
0.0963 0.1923
0.1284 0.2180
0.1905 0.2498
0.2753 0.2588

Mole fraction [ref]

Operational conditions:

Fixed Measured
Mole fraction of Isopropyl Alcohol (1) - Liquid mixture 2 Mole fraction of Isopropyl acetate (2) - Liquid mixture 2 Mole fraction of Isopropyl Alcohol (1) - Liquid mixture 1 Mole fraction of Isopropyl acetate (2) - Liquid mixture 1
0.0000 0.0031 0.0000 0.8822
0.0157 0.0031 0.1044 0.7072
0.0327 0.0035 0.1940 0.5456
0.0320 0.0042 0.2161 0.4881
0.0396 0.0056 0.2364 0.4070
0.0446 0.0058 0.2363 0.3270

Azeotropic temperature, K [ref]

Fixed Measured
Mole fraction of Isopropyl Alcohol (1) - Liquid Mole fraction of Water (3) - Liquid Azeotropic temperature, K - Liquid
0.0922 0.4010 349.20

Azeotropic temperature, K [ref]

Fixed Measured
Mole fraction of Isopropyl Alcohol (1) - Liquid Mole fraction of Water (3) - Liquid Azeotropic temperature, K - Liquid
0.0922 0.4010 349.20

Sources