Mixture of Omeprazole + 1-Butanol

Name: Omeprazole
InChI: InChI=1S/C17H19N3O3S/c1-10-8-18-15(11(2)16(10)23-4)9-24(21)17-19-13-6-5-12(22-3)7-14(13)20-17/h5-8H,9H2,1-4H3,(H,19,20)
InChI Key: SUBDBMMJDZJVOS-UHFFFAOYSA-N
Formula: C17H19N3O3S
SMILES: COc1ccc2nc(S(=O)Cc3ncc(C)c(OC)c3C)[nH]c2c1
Mol. Weight (g/mol): 345.42

Name: 1-Butanol
InChI: InChI=1S/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3
InChI Key: LRHPLDYGYMQRHN-UHFFFAOYSA-N
Formula: C4H10O
SMILES: CCCCO
Mol. Weight (g/mol): 74.12
CAS: 71-36-3

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Datasets

Mole fraction (2)

Mole fraction of Omeprazole (1) [ref]

Operational condition: Pressure, kPa = 100 (Liquid)

Temperature, K - Liquid	Mole fraction of Omeprazole (1) - Liquid
278.15	0.0013
283.15	0.0015
288.15	0.0020
293.15	0.0024
298.15	0.0030
303.15	0.0037
308.15	0.0046
313.15	0.0054
318.15	0.0065
323.15	0.0078
328.15	0.0088
333.15	0.0103

Mole fraction of Omeprazole (1) [ref]

Operational condition: Pressure, kPa = 100 (Liquid)

Temperature, K - Liquid	Mole fraction of Omeprazole (1) - Liquid
278.15	0.0013
283.15	0.0015
288.15	0.0020
293.15	0.0024
298.15	0.0030
303.15	0.0037
308.15	0.0046
313.15	0.0054
318.15	0.0065
323.15	0.0078
328.15	0.0088
333.15	0.0103

Sources

Thermodynamic models for determination of the solubility of omeprazole in pure and mixture organic solvents from T = (278.15 to 333.15) K

Note: These property values are available through the Cheméo API. A free account gives you an access key.