- 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
- Acetonitrile
- InChI
- InChI=1S/C2H3N/c1-2-3/h1H3
- InChI Key
- WEVYAHXRMPXWCK-UHFFFAOYSA-N
- Formula
- C2H3N
- SMILES
- CC#N
- Mol. Weight (g/mol)
- 41.05
- CAS
- 75-05-8
- Name
- Ethanol
- InChI
- InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3
- InChI Key
- LFQSCWFLJHTTHZ-UHFFFAOYSA-N
- Formula
- C2H6O
- SMILES
- CCO
- Mol. Weight (g/mol)
- 46.07
- CAS
- 64-17-5
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Datasets
Mole fraction of Indomethacin (1) [ref]
Operational conditions:
- Pressure, kPa = 100 (Liquid)
- Temperature, K = 298.15 (Liquid)
| Solvent: Mole fraction of Ethanol (3) - Liquid | Mole fraction of Indomethacin (1) - Liquid |
|---|---|
| 0.0000 | 0.0024 |
| 0.0900 | 0.0061 |
| 0.1820 | 0.0109 |
| 0.2760 | 0.0169 |
| 0.3730 | 0.0199 |
| 0.4710 | 0.0202 |
| 0.5720 | 0.0205 |
| 0.6750 | 0.0188 |
| 0.7810 | 0.0132 |
| 0.8890 | 0.0093 |
| 1.0000 | 0.0044 |
Mole fraction of Indomethacin (1) [ref]
Operational conditions:
- Pressure, kPa = 100 (Liquid)
- Temperature, K = 298.15 (Liquid)
| Solvent: Mole fraction of Ethanol (3) - Liquid | Mole fraction of Indomethacin (1) - Liquid |
|---|---|
| 0.0000 | 0.0024 |
| 0.0900 | 0.0061 |
| 0.1820 | 0.0109 |
| 0.2760 | 0.0169 |
| 0.3730 | 0.0199 |
| 0.4710 | 0.0202 |
| 0.5720 | 0.0205 |
| 0.6750 | 0.0188 |
| 0.7810 | 0.0132 |
| 0.8890 | 0.0093 |
| 1.0000 | 0.0044 |
Mass density, kg/m3 [ref]
Operational conditions:
- Temperature, K = 298.15 (Liquid)
- Pressure, kPa = 100 (Liquid)
| Solvent: Mole fraction of Ethanol (3) - Liquid | Mass density, kg/m3 - Liquid |
|---|---|
| 0.0000 | 782.0 |
| 0.0900 | 802.0 |
| 0.1820 | 813.0 |
| 0.2760 | 818.0 |
| 0.3730 | 824.0 |
| 0.4710 | 830.0 |
| 0.5720 | 830.0 |
| 0.6750 | 820.0 |
| 0.7810 | 810.0 |
| 0.8890 | 794.0 |
| 1.0000 | 786.0 |
Mass density, kg/m3 [ref]
Operational conditions:
- Temperature, K = 298.15 (Liquid)
- Pressure, kPa = 100 (Liquid)
| Solvent: Mole fraction of Ethanol (3) - Liquid | Mass density, kg/m3 - Liquid |
|---|---|
| 0.0000 | 782.0 |
| 0.0900 | 802.0 |
| 0.1820 | 813.0 |
| 0.2760 | 818.0 |
| 0.3730 | 824.0 |
| 0.4710 | 830.0 |
| 0.5720 | 830.0 |
| 0.6750 | 820.0 |
| 0.7810 | 810.0 |
| 0.8890 | 794.0 |
| 1.0000 | 786.0 |