Mixture of Ibuprofen + Acetone

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

Acetone

Name
Acetone
InChI
InChI=1S/C3H6O/c1-3(2)4/h1-2H3
InChI Key
CSCPPACGZOOCGX-UHFFFAOYSA-N
Formula
C3H6O
SMILES
CC(C)=O
Mol. Weight (g/mol)
58.08
CAS
67-64-1
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Datasets

  1. Mole fraction (2)

Mole fraction of Ibuprofen (1) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of Ibuprofen (1) - Liquid
283.57 0.1437
288.49 0.1684
293.37 0.1996
297.87 0.2330
303.25 0.2732
308.07 0.3114
312.65 0.3516
317.99 0.4051

Mole fraction of Ibuprofen (1) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of Ibuprofen (1) - Liquid
283.57 0.1437
288.49 0.1684
293.37 0.1996
297.87 0.2330
303.25 0.2732
308.07 0.3114
312.65 0.3516
317.99 0.4051

Sources