Mixture of Acetone + Trimethoprim

Excel

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

Trimethoprim

Name
Trimethoprim
InChI
InChI=1S/C14H18N4O3/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15/h5-7H,4H2,1-3H3,(H4,15,16,17,18)
InChI Key
IEDVJHCEMCRBQM-UHFFFAOYSA-N
Formula
C14H18N4O3
SMILES
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC
Mol. Weight (g/mol)
290.32
CAS
738-70-5
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Datasets

  1. Mole fraction (2)

Mole fraction of Trimethoprim (2) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of Trimethoprim (2) - Liquid
276.94 0.0005
282.12 0.0005
288.62 0.0007
292.94 0.0008
297.96 0.0009
304.17 0.0011
309.34 0.0013
314.34 0.0015
319.07 0.0017
323.51 0.0020

Mole fraction of Trimethoprim (2) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Temperature, K - Liquid Mole fraction of Trimethoprim (2) - Liquid
276.94 0.0005
282.12 0.0005
288.62 0.0007
292.94 0.0008
297.96 0.0009
304.17 0.0011
309.34 0.0013
314.34 0.0015
319.07 0.0017
323.51 0.0020

Sources