- 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
- Name
- Simvastatin
- InChI
- InChI=1S/C25H38O5/c1-6-25(4,5)24(28)30-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-19-13-18(26)14-22(27)29-19/h7-8,11,15-16,18-21,23,26H,6,9-10,12-14H2,1-5H3
- InChI Key
- RYMZZMVNJRMUDD-UHFFFAOYSA-N
- Formula
- C25H38O5
- SMILES
-
CCC(C)(C)C(=O)OC1CC(C)C=C2C=CC
(C)C(CCC3CC(O)CC(=O)O3)C21 - Mol. Weight (g/mol)
- 418.57
- CAS
- 79902-63-9
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Datasets
Mole fraction of Acetic acid, butyl ester (1) [ref]
Operational condition: Pressure, kPa = 101 (Liquid)
| Temperature, K - Liquid | Mole fraction of Acetic acid, butyl ester (1) - Liquid |
|---|---|
| 279.10 | 0.0229 |
| 282.20 | 0.0242 |
| 285.30 | 0.0255 |
| 288.50 | 0.0272 |
| 291.30 | 0.0286 |
| 296.10 | 0.0312 |
| 301.00 | 0.0345 |
| 305.80 | 0.0375 |
| 310.70 | 0.0409 |
| 315.50 | 0.0448 |
Mole fraction of Simvastatin (2) [ref]
Operational condition: Pressure, kPa = 101 (Liquid)
| Temperature, K - Liquid | Mole fraction of Simvastatin (2) - Liquid |
|---|---|
| 278.15 | 0.0193 |
| 283.15 | 0.0227 |
| 288.15 | 0.0251 |
| 293.15 | 0.0308 |
| 298.15 | 0.0345 |
| 303.15 | 0.0419 |
| 308.15 | 0.0503 |
| 313.15 | 0.0597 |
| 318.15 | 0.0703 |
Mole fraction of Acetic acid, butyl ester (1) [ref]
Operational condition: Pressure, kPa = 101 (Liquid)
| Temperature, K - Liquid | Mole fraction of Acetic acid, butyl ester (1) - Liquid |
|---|---|
| 279.10 | 0.0229 |
| 282.20 | 0.0242 |
| 285.30 | 0.0255 |
| 288.50 | 0.0272 |
| 291.30 | 0.0286 |
| 296.10 | 0.0312 |
| 301.00 | 0.0345 |
| 305.80 | 0.0375 |
| 310.70 | 0.0409 |
| 315.50 | 0.0448 |
Mole fraction of Simvastatin (2) [ref]
Operational condition: Pressure, kPa = 101 (Liquid)
| Temperature, K - Liquid | Mole fraction of Simvastatin (2) - Liquid |
|---|---|
| 278.15 | 0.0193 |
| 283.15 | 0.0227 |
| 288.15 | 0.0251 |
| 293.15 | 0.0308 |
| 298.15 | 0.0345 |
| 303.15 | 0.0419 |
| 308.15 | 0.0503 |
| 313.15 | 0.0597 |
| 318.15 | 0.0703 |