Mixture of Toluene + Pyrazinamide + 1,4-Dioxane

Excel

Toluene

Name
Toluene
InChI
InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3
InChI Key
YXFVVABEGXRONW-UHFFFAOYSA-N
Formula
C7H8
SMILES
Cc1ccccc1
Mol. Weight (g/mol)
92.14
CAS
108-88-3

Pyrazinamide

Name
Pyrazinamide
InChI
InChI=1S/C5H5N3O/c6-5(9)4-3-7-1-2-8-4/h1-3H,(H2,6,9)
InChI Key
IPEHBUMCGVEMRF-UHFFFAOYSA-N
Formula
C5H5N3O
SMILES
NC(=O)c1cnccn1
Mol. Weight (g/mol)
123.11
CAS
98-96-4

1,4-Dioxane

Name
1,4-Dioxane
InChI
InChI=1S/C4H8O2/c1-2-6-4-3-5-1/h1-4H2
InChI Key
RYHBNJHYFVUHQT-UHFFFAOYSA-N
Formula
C4H8O2
SMILES
C1COCCO1
Mol. Weight (g/mol)
88.11
CAS
123-91-1
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Datasets

  1. Mole fraction (2)

Mole fraction of Pyrazinamide (2) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Fixed Measured
Temperature, K - Liquid Solvent: Mass fraction of Toluene (1) - Liquid Mole fraction of Pyrazinamide (2) - Liquid
293.15 0.0000 0.0072
303.15 0.0000 0.0107
313.15 0.0000 0.0138
323.15 0.0000 0.0202
333.15 0.0000 0.0285
293.15 0.1000 0.0051
303.15 0.1000 0.0077
313.15 0.1000 0.0098
323.15 0.1000 0.0143
333.15 0.1000 0.0200
293.15 0.2000 0.0036
303.15 0.2000 0.0053
313.15 0.2000 0.0068
323.15 0.2000 0.0106
333.15 0.2000 0.0140
293.15 0.3000 0.0025
303.15 0.3000 0.0036
313.15 0.3000 0.0052
323.15 0.3000 0.0071
333.15 0.3000 0.0110
293.15 0.4000 0.0020
303.15 0.4000 0.0028
313.15 0.4000 0.0041
323.15 0.4000 0.0055
333.15 0.4000 0.0078
293.15 0.5000 0.0014
303.15 0.5000 0.0021
313.15 0.5000 0.0031
323.15 0.5000 0.0040
333.15 0.5000 0.0060
293.15 0.6000 0.0009
303.15 0.6000 0.0015
313.15 0.6000 0.0022
323.15 0.6000 0.0030
333.15 0.6000 0.0041
293.15 0.7000 0.0005
303.15 0.7000 0.0008
313.15 0.7000 0.0015
323.15 0.7000 0.0018
333.15 0.7000 0.0031

Mole fraction of Pyrazinamide (2) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Fixed Measured
Temperature, K - Liquid Solvent: Mass fraction of Toluene (1) - Liquid Mole fraction of Pyrazinamide (2) - Liquid
293.15 0.0000 0.0072
303.15 0.0000 0.0107
313.15 0.0000 0.0138
323.15 0.0000 0.0202
333.15 0.0000 0.0285
293.15 0.1000 0.0051
303.15 0.1000 0.0077
313.15 0.1000 0.0098
323.15 0.1000 0.0143
333.15 0.1000 0.0200
293.15 0.2000 0.0036
303.15 0.2000 0.0053
313.15 0.2000 0.0068
323.15 0.2000 0.0106
333.15 0.2000 0.0140
293.15 0.3000 0.0025
303.15 0.3000 0.0036
313.15 0.3000 0.0052
323.15 0.3000 0.0071
333.15 0.3000 0.0110
293.15 0.4000 0.0020
303.15 0.4000 0.0028
313.15 0.4000 0.0041
323.15 0.4000 0.0055
333.15 0.4000 0.0078
293.15 0.5000 0.0014
303.15 0.5000 0.0021
313.15 0.5000 0.0031
323.15 0.5000 0.0040
333.15 0.5000 0.0060
293.15 0.6000 0.0009
303.15 0.6000 0.0015
313.15 0.6000 0.0022
323.15 0.6000 0.0030
333.15 0.6000 0.0041
293.15 0.7000 0.0005
303.15 0.7000 0.0008
313.15 0.7000 0.0015
323.15 0.7000 0.0018
333.15 0.7000 0.0031

Sources