Mixture of fenbendazole + 1,2-Ethanediol + Water

fenbendazole

Name
fenbendazole
InChI
InChI=1S/C15H13N3O2S/c1-20-15(19)18-14-16-12-8-7-11(9-13(12)17-14)21-10-5-3-2-4-6-10/h2-9H,1H3,(H2,16,17,18,19)
InChI Key
HDDSHPAODJUKPD-UHFFFAOYSA-N
Formula
C15H13N3O2S
SMILES
COC(=O)Nc1nc2ccc(Sc3ccccc3)cc2[nH]1
Mol. Weight (g/mol)
299.35

1,2-Ethanediol

Name
1,2-Ethanediol
InChI
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
InChI Key
LYCAIKOWRPUZTN-UHFFFAOYSA-N
Formula
C2H6O2
SMILES
OCCO
Mol. Weight (g/mol)
62.07
CAS
107-21-1

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

Mole fraction of fenbendazole (1) [ref]

Operational condition: Pressure, kPa = 101.1 (Liquid)

Fixed Measured
Temperature, K - Liquid Solvent: Mass fraction of 1,2-Ethanediol (2) - Liquid Mole fraction of fenbendazole (1) - Liquid
283.15 1.0000 0.0001
288.15 1.0000 0.0002
293.15 1.0000 0.0002
298.15 1.0000 0.0003
303.15 1.0000 0.0004
308.15 1.0000 0.0005
313.15 1.0000 0.0006
318.15 1.0000 0.0008
323.15 1.0000 0.0010
328.15 1.0000 0.0013
283.15 0.8996 0.0001
288.15 0.8996 0.0001
293.15 0.8996 0.0002
298.15 0.8996 0.0003
303.15 0.8996 0.0004
308.15 0.8996 0.0004
313.15 0.8996 0.0006
318.15 0.8996 0.0007
323.15 0.8996 0.0009
328.15 0.8996 0.0011
283.15 0.8008 0.0001
288.15 0.8008 0.0001
293.15 0.8008 0.0002
298.15 0.8008 0.0002
303.15 0.8008 0.0003
308.15 0.8008 0.0004
313.15 0.8008 0.0005
318.15 0.8008 0.0006
323.15 0.8008 0.0007
328.15 0.8008 0.0009
283.15 0.6979 0.0001
288.15 0.6979 0.0001
293.15 0.6979 0.0002
298.15 0.6979 0.0002
303.15 0.6979 0.0003
308.15 0.6979 0.0003
313.15 0.6979 0.0004
318.15 0.6979 0.0005
323.15 0.6979 0.0006
328.15 0.6979 0.0008
283.15 0.6006 0.0001
288.15 0.6006 0.0001
293.15 0.6006 0.0001
298.15 0.6006 0.0002
303.15 0.6006 0.0002
308.15 0.6006 0.0003
313.15 0.6006 0.0003
318.15 0.6006 0.0004
323.15 0.6006 0.0005
328.15 0.6006 0.0006
283.15 0.4989 0.0001
288.15 0.4989 0.0001
293.15 0.4989 0.0001
298.15 0.4989 0.0001
303.15 0.4989 0.0002
308.15 0.4989 0.0002
313.15 0.4989 0.0003
318.15 0.4989 0.0003
323.15 0.4989 0.0004
328.15 0.4989 0.0005
283.15 0.4000 0.0001
288.15 0.4000 0.0001
293.15 0.4000 0.0001
298.15 0.4000 0.0001
303.15 0.4000 0.0001
308.15 0.4000 0.0002
313.15 0.4000 0.0002
318.15 0.4000 0.0003
323.15 0.4000 0.0003
328.15 0.4000 0.0004
283.15 0.3003 0.0001
288.15 0.3003 0.0001
293.15 0.3003 0.0001
298.15 0.3003 0.0001
303.15 0.3003 0.0001
308.15 0.3003 0.0002
313.15 0.3003 0.0002
318.15 0.3003 0.0002
323.15 0.3003 0.0003
328.15 0.3003 0.0003
283.15 0.2012 0.0000
288.15 0.2012 0.0000
293.15 0.2012 0.0001
298.15 0.2012 0.0001
303.15 0.2012 0.0001
308.15 0.2012 0.0001
313.15 0.2012 0.0001
318.15 0.2012 0.0001
323.15 0.2012 0.0002
328.15 0.2012 0.0002
283.15 0.0998 0.0000
288.15 0.0998 0.0000
293.15 0.0998 0.0000
298.15 0.0998 0.0000
303.15 0.0998 0.0000
308.15 0.0998 0.0000
313.15 0.0998 0.0001
318.15 0.0998 0.0001
323.15 0.0998 0.0001
328.15 0.0998 0.0001
283.15 0.0000 3.6920e-06
288.15 0.0000 4.5110e-06
293.15 0.0000 5.7090e-06
298.15 0.0000 7.2460e-06
303.15 0.0000 9.0300e-06
308.15 0.0000 0.0000
313.15 0.0000 0.0000
318.15 0.0000 0.0000
323.15 0.0000 0.0000
328.15 0.0000 0.0000

Sources