Mixture of Isopropyl Alcohol + Isoniazid + Water

Excel

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

Isoniazid

Name
Isoniazid
InChI
InChI=1S/C6H7N3O/c7-9-6(10)5-1-3-8-4-2-5/h1-4H,7H2,(H,9,10)
InChI Key
QRXWMOHMRWLFEY-UHFFFAOYSA-N
Formula
C6H7N3O
SMILES
NNC(=O)c1ccncc1
Mol. Weight (g/mol)
137.14
CAS
54-85-3

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. Mole fraction (2)

Mole fraction of Isoniazid (2) [ref]

Operational condition: Pressure, kPa = 100 (Liquid)

Fixed Measured
Temperature, K - Liquid Solvent: Mole fraction of Isopropyl Alcohol (1) - Liquid Mole fraction of Isoniazid (2) - Liquid
283.15 0.0000 0.0106
283.15 0.1000 0.0171
283.15 0.2000 0.0212
283.15 0.3000 0.0216
283.15 0.4000 0.0202
283.15 0.5000 0.0175
283.15 0.6000 0.0136
283.15 0.7000 0.0103
283.15 0.8000 0.0069
283.15 0.9000 0.0043
283.15 1.0000 0.0021
288.15 0.0000 0.0134
288.15 0.1000 0.0208
288.15 0.2000 0.0256
288.15 0.3000 0.0254
288.15 0.4000 0.0232
288.15 0.5000 0.0204
288.15 0.6000 0.0159
288.15 0.7000 0.0120
288.15 0.8000 0.0079
288.15 0.9000 0.0051
288.15 1.0000 0.0025
293.15 0.0000 0.0159
293.15 0.1000 0.0258
293.15 0.2000 0.0306
293.15 0.3000 0.0298
293.15 0.4000 0.0270
293.15 0.5000 0.0231
293.15 0.6000 0.0177
293.15 0.7000 0.0134
293.15 0.8000 0.0093
293.15 0.9000 0.0060
293.15 1.0000 0.0031
298.15 0.0000 0.0198
298.15 0.1000 0.0312
298.15 0.2000 0.0358
298.15 0.3000 0.0344
298.15 0.4000 0.0308
298.15 0.5000 0.0269
298.15 0.6000 0.0205
298.15 0.7000 0.0152
298.15 0.8000 0.0109
298.15 0.9000 0.0070
298.15 1.0000 0.0037
303.15 0.0000 0.0240
303.15 0.1000 0.0396
303.15 0.2000 0.0438
303.15 0.3000 0.0410
303.15 0.4000 0.0364
303.15 0.5000 0.0312
303.15 0.6000 0.0240
303.15 0.7000 0.0183
303.15 0.8000 0.0129
303.15 0.9000 0.0085
303.15 1.0000 0.0045
308.15 0.0000 0.0296
308.15 0.1000 0.0460
308.15 0.2000 0.0496
308.15 0.3000 0.0470
308.15 0.4000 0.0415
308.15 0.5000 0.0358
308.15 0.6000 0.0275
308.15 0.7000 0.0209
308.15 0.8000 0.0148
308.15 0.9000 0.0102
308.15 1.0000 0.0056
313.15 0.0000 0.0354
313.15 0.1000 0.0551
313.15 0.2000 0.0587
313.15 0.3000 0.0545
313.15 0.4000 0.0477
313.15 0.5000 0.0404
313.15 0.6000 0.0314
313.15 0.7000 0.0233
313.15 0.8000 0.0173
313.15 0.9000 0.0117
313.15 1.0000 0.0065
318.15 0.0000 0.0421
318.15 0.1000 0.0633
318.15 0.2000 0.0664
318.15 0.3000 0.0615
318.15 0.4000 0.0542
318.15 0.5000 0.0466
318.15 0.6000 0.0355
318.15 0.7000 0.0270
318.15 0.8000 0.0200
318.15 0.9000 0.0136
318.15 1.0000 0.0080
323.15 0.0000 0.0517
323.15 0.1000 0.0738
323.15 0.2000 0.0760
323.15 0.3000 0.0700
323.15 0.4000 0.0621
323.15 0.5000 0.0523
323.15 0.6000 0.0398
323.15 0.7000 0.0306
323.15 0.8000 0.0230
323.15 0.9000 0.0159
323.15 1.0000 0.0095

Mole fraction of Isoniazid (2) [ref]

Operational condition: Pressure, kPa = 100 (Liquid)

Fixed Measured
Temperature, K - Liquid Solvent: Mole fraction of Isopropyl Alcohol (1) - Liquid Mole fraction of Isoniazid (2) - Liquid
283.15 0.0000 0.0106
283.15 0.1000 0.0171
283.15 0.2000 0.0212
283.15 0.3000 0.0216
283.15 0.4000 0.0202
283.15 0.5000 0.0175
283.15 0.6000 0.0136
283.15 0.7000 0.0103
283.15 0.8000 0.0069
283.15 0.9000 0.0043
283.15 1.0000 0.0021
288.15 0.0000 0.0134
288.15 0.1000 0.0208
288.15 0.2000 0.0256
288.15 0.3000 0.0254
288.15 0.4000 0.0232
288.15 0.5000 0.0204
288.15 0.6000 0.0159
288.15 0.7000 0.0120
288.15 0.8000 0.0079
288.15 0.9000 0.0051
288.15 1.0000 0.0025
293.15 0.0000 0.0159
293.15 0.1000 0.0258
293.15 0.2000 0.0306
293.15 0.3000 0.0298
293.15 0.4000 0.0270
293.15 0.5000 0.0231
293.15 0.6000 0.0177
293.15 0.7000 0.0134
293.15 0.8000 0.0093
293.15 0.9000 0.0060
293.15 1.0000 0.0031
298.15 0.0000 0.0198
298.15 0.1000 0.0312
298.15 0.2000 0.0358
298.15 0.3000 0.0344
298.15 0.4000 0.0308
298.15 0.5000 0.0269
298.15 0.6000 0.0205
298.15 0.7000 0.0152
298.15 0.8000 0.0109
298.15 0.9000 0.0070
298.15 1.0000 0.0037
303.15 0.0000 0.0240
303.15 0.1000 0.0396
303.15 0.2000 0.0438
303.15 0.3000 0.0410
303.15 0.4000 0.0364
303.15 0.5000 0.0312
303.15 0.6000 0.0240
303.15 0.7000 0.0183
303.15 0.8000 0.0129
303.15 0.9000 0.0085
303.15 1.0000 0.0045
308.15 0.0000 0.0296
308.15 0.1000 0.0460
308.15 0.2000 0.0496
308.15 0.3000 0.0470
308.15 0.4000 0.0415
308.15 0.5000 0.0358
308.15 0.6000 0.0275
308.15 0.7000 0.0209
308.15 0.8000 0.0148
308.15 0.9000 0.0102
308.15 1.0000 0.0056
313.15 0.0000 0.0354
313.15 0.1000 0.0551
313.15 0.2000 0.0587
313.15 0.3000 0.0545
313.15 0.4000 0.0477
313.15 0.5000 0.0404
313.15 0.6000 0.0314
313.15 0.7000 0.0233
313.15 0.8000 0.0173
313.15 0.9000 0.0117
313.15 1.0000 0.0065
318.15 0.0000 0.0421
318.15 0.1000 0.0633
318.15 0.2000 0.0664
318.15 0.3000 0.0615
318.15 0.4000 0.0542
318.15 0.5000 0.0466
318.15 0.6000 0.0355
318.15 0.7000 0.0270
318.15 0.8000 0.0200
318.15 0.9000 0.0136
318.15 1.0000 0.0080
323.15 0.0000 0.0517
323.15 0.1000 0.0738
323.15 0.2000 0.0760
323.15 0.3000 0.0700
323.15 0.4000 0.0621
323.15 0.5000 0.0523
323.15 0.6000 0.0398
323.15 0.7000 0.0306
323.15 0.8000 0.0230
323.15 0.9000 0.0159
323.15 1.0000 0.0095

Sources