- Name
- Pentanoic acid, 4-oxo-
- InChI
- InChI=1S/C5H8O3/c1-4(6)2-3-5(7)8/h2-3H2,1H3,(H,7,8)
- InChI Key
- JOOXCMJARBKPKM-UHFFFAOYSA-N
- Formula
- C5H8O3
- SMILES
- CC(=O)CCC(=O)O
- Mol. Weight (g/mol)
- 116.12
- CAS
- 123-76-2
- Name
- Acetic acid, cyclohexyl ester
- InChI
- InChI=1S/C8H14O2/c1-7(9)10-8-5-3-2-4-6-8/h8H,2-6H2,1H3
- InChI Key
- YYLLIJHXUHJATK-UHFFFAOYSA-N
- Formula
- C8H14O2
- SMILES
- CC(=O)OC1CCCCC1
- Mol. Weight (g/mol)
- 142.20
- CAS
- 622-45-7
- 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
Mass fraction [ref]
Operational conditions:
- Temperature, K = 298.2 (Liquid mixture 1)
- Pressure, kPa = 101.35 (Liquid mixture 1)
| Fixed | Measured | ||
|---|---|---|---|
| Mass fraction of Water (3) - Liquid mixture 1 | Mass fraction of Pentanoic acid, 4-oxo- (1) - Liquid mixture 1 | Mass fraction of Water (3) - Liquid mixture 2 | Mass fraction of Pentanoic acid, 4-oxo- (1) - Liquid mixture 2 |
| 0.9980 | 0.0000 | 0.0056 | 0.0000 |
| 0.9231 | 0.0625 | 0.0750 | 0.0465 |
| 0.8354 | 0.1434 | 0.0848 | 0.1126 |
| 0.7203 | 0.2502 | 0.0961 | 0.2142 |
| 0.6170 | 0.3473 | 0.1120 | 0.3157 |
| 0.5070 | 0.4340 | 0.1585 | 0.4232 |
Mass fraction [ref]
Operational conditions:
- Temperature, K = 298.2 (Liquid mixture 1)
- Pressure, kPa = 101.35 (Liquid mixture 1)
| Fixed | Measured | ||
|---|---|---|---|
| Mass fraction of Water (3) - Liquid mixture 1 | Mass fraction of Pentanoic acid, 4-oxo- (1) - Liquid mixture 1 | Mass fraction of Water (3) - Liquid mixture 2 | Mass fraction of Pentanoic acid, 4-oxo- (1) - Liquid mixture 2 |
| 0.9980 | 0.0000 | 0.0056 | 0.0000 |
| 0.9231 | 0.0625 | 0.0750 | 0.0465 |
| 0.8354 | 0.1434 | 0.0848 | 0.1126 |
| 0.7203 | 0.2502 | 0.0961 | 0.2142 |
| 0.6170 | 0.3473 | 0.1120 | 0.3157 |
| 0.5070 | 0.4340 | 0.1585 | 0.4232 |