- Name
- Captopril
- InChI
- InChI=1S/C9H15NO3S/c1-6(5-14)8(11)10-4-2-3-7(10)9(12)13/h6-7,14H,2-5H2,1H3,(H,12,13)/t6-,7+/m0/s1
- InChI Key
- FAKRSMQSSFJEIM-NKWVEPMBSA-N
- Formula
- C9H15NO3S
- SMILES
- CC(CS)C(=O)N1CCCC1C(=O)O
- Mol. Weight (g/mol)
- 217.28
- CAS
- 62571-86-2
- Name
- Acetic acid, butyl ester
- InChI
- InChI=1S/C6H12O2/c1-3-4-5-8-6(2)7/h3-5H2,1-2H3
- InChI Key
- DKPFZGUDAPQIHT-UHFFFAOYSA-N
- Formula
- C6H12O2
- SMILES
- CCCCOC(C)=O
- Mol. Weight (g/mol)
- 116.16
- CAS
- 123-86-4
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Datasets
Mole fraction of Captopril (1) [ref]
Operational condition: Pressure, kPa = 101 (Liquid)
| Temperature, K - Liquid | Mole fraction of Captopril (1) - Liquid |
|---|---|
| 278.15 | 0.0462 |
| 283.15 | 0.0580 |
| 288.15 | 0.0710 |
| 293.15 | 0.0868 |
| 298.15 | 0.1066 |
| 303.15 | 0.1311 |
| 308.15 | 0.1619 |
| 313.15 | 0.2019 |
Mole fraction of Captopril (1) [ref]
Operational condition: Pressure, kPa = 101 (Liquid)
| Temperature, K - Liquid | Mole fraction of Captopril (1) - Liquid |
|---|---|
| 278.15 | 0.0462 |
| 283.15 | 0.0580 |
| 288.15 | 0.0710 |
| 293.15 | 0.0868 |
| 298.15 | 0.1066 |
| 303.15 | 0.1311 |
| 308.15 | 0.1619 |
| 313.15 | 0.2019 |