- Name
- Isobutyl acetate
- InChI
- InChI=1S/C6H12O2/c1-5(2)4-8-6(3)7/h5H,4H2,1-3H3
- InChI Key
- GJRQTCIYDGXPES-UHFFFAOYSA-N
- Formula
- C6H12O2
- SMILES
- CC(=O)OCC(C)C
- Mol. Weight (g/mol)
- 116.16
- CAS
- 110-19-0
- Name
- Aspirin
- InChI
- InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12)
- InChI Key
- BSYNRYMUTXBXSQ-UHFFFAOYSA-N
- Formula
- C9H8O4
- SMILES
- CC(=O)Oc1ccccc1C(=O)O
- Mol. Weight (g/mol)
- 180.16
- CAS
- 50-78-2
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Datasets
Mole fraction of Aspirin (2) [ref]
Operational condition: Pressure, kPa = 100 (Liquid)
| Temperature, K - Liquid | Mole fraction of Aspirin (2) - Liquid |
|---|---|
| 277.86 | 0.0109 |
| 281.16 | 0.0124 |
| 287.78 | 0.0157 |
| 293.97 | 0.0198 |
| 300.25 | 0.0247 |
| 307.15 | 0.0306 |
| 313.56 | 0.0376 |
| 320.16 | 0.0460 |
| 327.15 | 0.0559 |
Mole fraction of Aspirin (2) [ref]
Operational condition: Pressure, kPa = 100 (Liquid)
| Temperature, K - Liquid | Mole fraction of Aspirin (2) - Liquid |
|---|---|
| 277.86 | 0.0109 |
| 281.16 | 0.0124 |
| 287.78 | 0.0157 |
| 293.97 | 0.0198 |
| 300.25 | 0.0247 |
| 307.15 | 0.0306 |
| 313.56 | 0.0376 |
| 320.16 | 0.0460 |
| 327.15 | 0.0559 |