- Name
- Indomethacin
- InChI
- InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)
- InChI Key
- CGIGDMFJXJATDK-UHFFFAOYSA-N
- Formula
- C19H16ClNO4
- SMILES
-
COc1ccc2c(c1)c(CC(=O)O)c(C)n2C
(=O)c1ccc(Cl)cc1 - Mol. Weight (g/mol)
- 357.79
- CAS
- 53-86-1
- 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
- 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
Mole fraction of Indomethacin (1) [ref]
Operational condition: Pressure, kPa = 101.3 (Liquid mixture 1)
| Fixed | Measured | |
|---|---|---|
| Solvent: Mass fraction of 1,4-Dioxane (2) - Liquid mixture 1 | Temperature, K - Liquid mixture 1 | Mole fraction of Indomethacin (1) - Liquid mixture 1 |
| 0.0000 | 293.15 | 7.8100e-07 |
| 0.0000 | 298.15 | 9.3200e-07 |
| 0.0000 | 303.15 | 1.1040e-06 |
| 0.0000 | 308.15 | 1.2740e-06 |
| 0.0000 | 313.15 | 1.5200e-06 |
| 0.1000 | 293.15 | 1.9310e-06 |
| 0.1000 | 298.15 | 2.3190e-06 |
| 0.1000 | 303.15 | 2.7900e-06 |
| 0.1000 | 308.15 | 3.3990e-06 |
| 0.1000 | 313.15 | 4.0980e-06 |
| 0.2000 | 293.15 | 3.7600e-06 |
| 0.2000 | 298.15 | 4.6000e-06 |
| 0.2000 | 303.15 | 5.8000e-06 |
| 0.2000 | 308.15 | 6.9900e-06 |
| 0.2000 | 313.15 | 8.6900e-06 |
| 0.3000 | 293.15 | 7.9900e-06 |
| 0.3000 | 298.15 | 9.9300e-06 |
| 0.3000 | 303.15 | 0.0000 |
| 0.3000 | 308.15 | 0.0000 |
| 0.3000 | 313.15 | 0.0000 |
| 0.4000 | 293.15 | 0.0000 |
| 0.4000 | 298.15 | 0.0000 |
| 0.4000 | 303.15 | 0.0001 |
| 0.4000 | 308.15 | 0.0001 |
| 0.4000 | 313.15 | 0.0001 |
| 0.5000 | 293.15 | 0.0002 |
| 0.5000 | 298.15 | 0.0002 |
| 0.5000 | 303.15 | 0.0003 |
| 0.5000 | 308.15 | 0.0004 |
| 0.5000 | 313.15 | 0.0005 |
| 0.6000 | 293.15 | 0.0009 |
| 0.6000 | 298.15 | 0.0011 |
| 0.6000 | 303.15 | 0.0016 |
| 0.6000 | 308.15 | 0.0020 |
| 0.6000 | 313.15 | 0.0026 |
| 0.7000 | 293.15 | 0.0040 |
| 0.7000 | 298.15 | 0.0049 |
| 0.7000 | 303.15 | 0.0065 |
| 0.7000 | 308.15 | 0.0083 |
| 0.7000 | 313.15 | 0.0111 |
| 0.7500 | 293.15 | 0.0065 |
| 0.7500 | 298.15 | 0.0086 |
| 0.7500 | 303.15 | 0.0109 |
| 0.7500 | 308.15 | 0.0136 |
| 0.7500 | 313.15 | 0.0167 |
| 0.8000 | 293.15 | 0.0131 |
| 0.8000 | 298.15 | 0.0159 |
| 0.8000 | 303.15 | 0.0198 |
| 0.8000 | 308.15 | 0.0242 |
| 0.8000 | 313.15 | 0.0285 |
| 0.8500 | 293.15 | 0.0197 |
| 0.8500 | 298.15 | 0.0230 |
| 0.8500 | 303.15 | 0.0271 |
| 0.8500 | 308.15 | 0.0328 |
| 0.8500 | 313.15 | 0.0381 |
| 0.9000 | 293.15 | 0.0279 |
| 0.9000 | 298.15 | 0.0317 |
| 0.9000 | 303.15 | 0.0372 |
| 0.9000 | 308.15 | 0.0423 |
| 0.9000 | 313.15 | 0.0486 |
| 0.9500 | 293.15 | 0.0359 |
| 0.9500 | 298.15 | 0.0399 |
| 0.9500 | 303.15 | 0.0448 |
| 0.9500 | 308.15 | 0.0505 |
| 0.9500 | 313.15 | 0.0565 |
| 1.0000 | 293.15 | 0.0249 |
| 1.0000 | 298.15 | 0.0290 |
| 1.0000 | 303.15 | 0.0343 |
| 1.0000 | 308.15 | 0.0416 |
| 1.0000 | 313.15 | 0.0477 |
Mole fraction of Indomethacin (1) [ref]
Operational condition: Pressure, kPa = 101.3 (Liquid mixture 1)
| Fixed | Measured | |
|---|---|---|
| Solvent: Mass fraction of 1,4-Dioxane (2) - Liquid mixture 1 | Temperature, K - Liquid mixture 1 | Mole fraction of Indomethacin (1) - Liquid mixture 1 |
| 0.0000 | 293.15 | 7.8100e-07 |
| 0.0000 | 298.15 | 9.3200e-07 |
| 0.0000 | 303.15 | 1.1040e-06 |
| 0.0000 | 308.15 | 1.2740e-06 |
| 0.0000 | 313.15 | 1.5200e-06 |
| 0.1000 | 293.15 | 1.9310e-06 |
| 0.1000 | 298.15 | 2.3190e-06 |
| 0.1000 | 303.15 | 2.7900e-06 |
| 0.1000 | 308.15 | 3.3990e-06 |
| 0.1000 | 313.15 | 4.0980e-06 |
| 0.2000 | 293.15 | 3.7600e-06 |
| 0.2000 | 298.15 | 4.6000e-06 |
| 0.2000 | 303.15 | 5.8000e-06 |
| 0.2000 | 308.15 | 6.9900e-06 |
| 0.2000 | 313.15 | 8.6900e-06 |
| 0.3000 | 293.15 | 7.9900e-06 |
| 0.3000 | 298.15 | 9.9300e-06 |
| 0.3000 | 303.15 | 0.0000 |
| 0.3000 | 308.15 | 0.0000 |
| 0.3000 | 313.15 | 0.0000 |
| 0.4000 | 293.15 | 0.0000 |
| 0.4000 | 298.15 | 0.0000 |
| 0.4000 | 303.15 | 0.0001 |
| 0.4000 | 308.15 | 0.0001 |
| 0.4000 | 313.15 | 0.0001 |
| 0.5000 | 293.15 | 0.0002 |
| 0.5000 | 298.15 | 0.0002 |
| 0.5000 | 303.15 | 0.0003 |
| 0.5000 | 308.15 | 0.0004 |
| 0.5000 | 313.15 | 0.0005 |
| 0.6000 | 293.15 | 0.0009 |
| 0.6000 | 298.15 | 0.0011 |
| 0.6000 | 303.15 | 0.0016 |
| 0.6000 | 308.15 | 0.0020 |
| 0.6000 | 313.15 | 0.0026 |
| 0.7000 | 293.15 | 0.0040 |
| 0.7000 | 298.15 | 0.0049 |
| 0.7000 | 303.15 | 0.0065 |
| 0.7000 | 308.15 | 0.0083 |
| 0.7000 | 313.15 | 0.0111 |
| 0.7500 | 293.15 | 0.0065 |
| 0.7500 | 298.15 | 0.0086 |
| 0.7500 | 303.15 | 0.0109 |
| 0.7500 | 308.15 | 0.0136 |
| 0.7500 | 313.15 | 0.0167 |
| 0.8000 | 293.15 | 0.0131 |
| 0.8000 | 298.15 | 0.0159 |
| 0.8000 | 303.15 | 0.0198 |
| 0.8000 | 308.15 | 0.0242 |
| 0.8000 | 313.15 | 0.0285 |
| 0.8500 | 293.15 | 0.0197 |
| 0.8500 | 298.15 | 0.0230 |
| 0.8500 | 303.15 | 0.0271 |
| 0.8500 | 308.15 | 0.0328 |
| 0.8500 | 313.15 | 0.0381 |
| 0.9000 | 293.15 | 0.0279 |
| 0.9000 | 298.15 | 0.0317 |
| 0.9000 | 303.15 | 0.0372 |
| 0.9000 | 308.15 | 0.0423 |
| 0.9000 | 313.15 | 0.0486 |
| 0.9500 | 293.15 | 0.0359 |
| 0.9500 | 298.15 | 0.0399 |
| 0.9500 | 303.15 | 0.0448 |
| 0.9500 | 308.15 | 0.0505 |
| 0.9500 | 313.15 | 0.0565 |
| 1.0000 | 293.15 | 0.0249 |
| 1.0000 | 298.15 | 0.0290 |
| 1.0000 | 303.15 | 0.0343 |
| 1.0000 | 308.15 | 0.0416 |
| 1.0000 | 313.15 | 0.0477 |