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Mixture of Sulfadiazine + 1,4-Dioxane + Water

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Sulfadiazine

Name
Sulfadiazine
InChI
InChI=1S/C10H10N4O2S/c11-8-2-4-9(5-3-8)17(15,16)14-10-12-6-1-7-13-10/h1-7H,11H2,(H,12,13,14)
InChI Key
SEEPANYCNGTZFQ-UHFFFAOYSA-N
Formula
C10H10N4O2S
SMILES
Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1
Mol. Weight (g/mol)
250.28
CAS
68-35-9

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

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 (2)

Mole fraction of Sulfadiazine (1) [ref]

Operational condition: Pressure, kPa = 73.9 (Liquid)

Fixed Measured
Temperature, K - Liquid Solvent: Mole fraction of 1,4-Dioxane (2) - Liquid Mole fraction of Sulfadiazine (1) - Liquid
293.15 0.0000 3.7990e-06
293.15 0.0222 9.6800e-06
293.15 0.0486 0.0000
293.15 0.0806 0.0001
293.15 0.1200 0.0001
293.15 0.1698 0.0002
293.15 0.2347 0.0004
293.15 0.3230 0.0007
293.15 0.3802 0.0009
293.15 0.4499 0.0011
293.15 0.5368 0.0012
293.15 0.6479 0.0012
293.15 0.7161 0.0012
293.15 0.7953 0.0010
293.15 0.8886 0.0007
293.15 1.0000 0.0004
298.15 0.0000 4.8090e-06
298.15 0.0222 0.0000
298.15 0.0486 0.0000
298.15 0.0806 0.0001
298.15 0.1200 0.0002
298.15 0.1698 0.0003
298.15 0.2347 0.0005
298.15 0.3230 0.0009
298.15 0.3802 0.0011
298.15 0.4499 0.0013
298.15 0.5368 0.0015
298.15 0.6479 0.0015
298.15 0.7161 0.0014
298.15 0.7953 0.0012
298.15 0.8886 0.0009
298.15 1.0000 0.0006
303.15 0.0000 6.4900e-06
303.15 0.0222 0.0000
303.15 0.0486 0.0000
303.15 0.0806 0.0001
303.15 0.1200 0.0002
303.15 0.1698 0.0004
303.15 0.2347 0.0007
303.15 0.3230 0.0011
303.15 0.3802 0.0013
303.15 0.4499 0.0016
303.15 0.5368 0.0018
303.15 0.6479 0.0018
303.15 0.7161 0.0017
303.15 0.7953 0.0015
303.15 0.8886 0.0012
303.15 1.0000 0.0008
308.15 0.0000 8.6800e-06
308.15 0.0222 0.0000
308.15 0.0486 0.0001
308.15 0.0806 0.0001
308.15 0.1200 0.0003
308.15 0.1698 0.0005
308.15 0.2347 0.0008
308.15 0.3230 0.0013
308.15 0.3802 0.0017
308.15 0.4499 0.0019
308.15 0.5368 0.0022
308.15 0.6479 0.0022
308.15 0.7161 0.0020
308.15 0.7953 0.0018
308.15 0.8886 0.0015
308.15 1.0000 0.0011
313.15 0.0000 0.0000
313.15 0.0222 0.0000
313.15 0.0486 0.0001
313.15 0.0806 0.0002
313.15 0.1200 0.0003
313.15 0.1698 0.0006
313.15 0.2347 0.0011
313.15 0.3230 0.0016
313.15 0.3802 0.0020
313.15 0.4499 0.0023
313.15 0.5368 0.0026
313.15 0.6479 0.0026
313.15 0.7161 0.0024
313.15 0.7953 0.0022
313.15 0.8886 0.0018
313.15 1.0000 0.0014

Mole fraction of Sulfadiazine (1) [ref]

Operational condition: Pressure, kPa = 73.9 (Liquid)

Fixed Measured
Temperature, K - Liquid Solvent: Mole fraction of 1,4-Dioxane (2) - Liquid Mole fraction of Sulfadiazine (1) - Liquid
293.15 0.0000 3.7990e-06
293.15 0.0222 9.6800e-06
293.15 0.0486 0.0000
293.15 0.0806 0.0001
293.15 0.1200 0.0001
293.15 0.1698 0.0002
293.15 0.2347 0.0004
293.15 0.3230 0.0007
293.15 0.3802 0.0009
293.15 0.4499 0.0011
293.15 0.5368 0.0012
293.15 0.6479 0.0012
293.15 0.7161 0.0012
293.15 0.7953 0.0010
293.15 0.8886 0.0007
293.15 1.0000 0.0004
298.15 0.0000 4.8090e-06
298.15 0.0222 0.0000
298.15 0.0486 0.0000
298.15 0.0806 0.0001
298.15 0.1200 0.0002
298.15 0.1698 0.0003
298.15 0.2347 0.0005
298.15 0.3230 0.0009
298.15 0.3802 0.0011
298.15 0.4499 0.0013
298.15 0.5368 0.0015
298.15 0.6479 0.0015
298.15 0.7161 0.0014
298.15 0.7953 0.0012
298.15 0.8886 0.0009
298.15 1.0000 0.0006
303.15 0.0000 6.4900e-06
303.15 0.0222 0.0000
303.15 0.0486 0.0000
303.15 0.0806 0.0001
303.15 0.1200 0.0002
303.15 0.1698 0.0004
303.15 0.2347 0.0007
303.15 0.3230 0.0011
303.15 0.3802 0.0013
303.15 0.4499 0.0016
303.15 0.5368 0.0018
303.15 0.6479 0.0018
303.15 0.7161 0.0017
303.15 0.7953 0.0015
303.15 0.8886 0.0012
303.15 1.0000 0.0008
308.15 0.0000 8.6800e-06
308.15 0.0222 0.0000
308.15 0.0486 0.0001
308.15 0.0806 0.0001
308.15 0.1200 0.0003
308.15 0.1698 0.0005
308.15 0.2347 0.0008
308.15 0.3230 0.0013
308.15 0.3802 0.0017
308.15 0.4499 0.0019
308.15 0.5368 0.0022
308.15 0.6479 0.0022
308.15 0.7161 0.0020
308.15 0.7953 0.0018
308.15 0.8886 0.0015
308.15 1.0000 0.0011
313.15 0.0000 0.0000
313.15 0.0222 0.0000
313.15 0.0486 0.0001
313.15 0.0806 0.0002
313.15 0.1200 0.0003
313.15 0.1698 0.0006
313.15 0.2347 0.0011
313.15 0.3230 0.0016
313.15 0.3802 0.0020
313.15 0.4499 0.0023
313.15 0.5368 0.0026
313.15 0.6479 0.0026
313.15 0.7161 0.0024
313.15 0.7953 0.0022
313.15 0.8886 0.0018
313.15 1.0000 0.0014

Sources