Mixture of Ibuprofen + Ethanol + Water

Excel

Ibuprofen

Name
Ibuprofen
InChI
InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)
InChI Key
HEFNNWSXXWATRW-UHFFFAOYSA-N
Formula
C13H18O2
SMILES
CC(C)Cc1ccc(C(C)C(=O)O)cc1
Mol. Weight (g/mol)
206.28
CAS
15687-27-1

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. Mass fraction (4)

Mass fraction of Ibuprofen (1) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Fixed Measured
Temperature, K - Liquid Solvent: Mass fraction of Water (3) - Liquid Mass fraction of Ibuprofen (1) - Liquid
283.15 0.0000 0.3700
283.15 0.1050 0.3010
283.15 0.2030 0.2170
283.15 0.2990 0.1220
283.15 0.4000 0.0590
283.15 0.4980 0.0190
283.15 0.5940 0.0030
283.15 0.6450 0.0010
298.15 0.0000 0.5310
298.15 0.0920 0.5090
298.15 0.1180 0.4970
298.15 0.1350 0.4870
298.15 0.2230 0.4220
298.15 0.2480 0.3670
298.15 0.3520 0.2540
298.15 0.3720 0.2440
298.15 0.4180 0.1640
298.15 0.4600 0.1110
298.15 0.4800 0.0860
298.15 0.5680 0.0300
298.15 0.5720 0.0230
298.15 0.6730 0.0030
298.15 0.6850 0.0020
298.15 0.7440 0.0030
298.15 0.8300 0.0010
313.15 0.0000 0.6810
313.15 0.1050 0.6760
313.15 0.2030 0.6490
313.15 0.2990 0.6060
313.15 0.7040 0.0060

Mass fraction of Ibuprofen (1) [ref]

Operational conditions:

Temperature, K - Liquid Mass fraction of Ibuprofen (1) - Liquid
298.15 0.3200
313.15 0.5450

Mass fraction of Ibuprofen (1) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Fixed Measured
Temperature, K - Liquid Solvent: Mass fraction of Water (3) - Liquid Mass fraction of Ibuprofen (1) - Liquid
283.15 0.0000 0.3700
283.15 0.1050 0.3010
283.15 0.2030 0.2170
283.15 0.2990 0.1220
283.15 0.4000 0.0590
283.15 0.4980 0.0190
283.15 0.5940 0.0030
283.15 0.6450 0.0010
298.15 0.0000 0.5310
298.15 0.0920 0.5090
298.15 0.1180 0.4970
298.15 0.1350 0.4870
298.15 0.2230 0.4220
298.15 0.2480 0.3670
298.15 0.3520 0.2540
298.15 0.3720 0.2440
298.15 0.4180 0.1640
298.15 0.4600 0.1110
298.15 0.4800 0.0860
298.15 0.5680 0.0300
298.15 0.5720 0.0230
298.15 0.6730 0.0030
298.15 0.6850 0.0020
298.15 0.7440 0.0030
298.15 0.8300 0.0010
313.15 0.0000 0.6810
313.15 0.1050 0.6760
313.15 0.2030 0.6490
313.15 0.2990 0.6060
313.15 0.7040 0.0060

Mass fraction of Ibuprofen (1) [ref]

Operational conditions:

Temperature, K - Liquid Mass fraction of Ibuprofen (1) - Liquid
298.15 0.3200
313.15 0.5450

Sources