- Name
- Acetic acid, methyl ester
- InChI
- InChI=1S/C3H6O2/c1-3(4)5-2/h1-2H3
- InChI Key
- KXKVLQRXCPHEJC-UHFFFAOYSA-N
- Formula
- C3H6O2
- SMILES
- COC(C)=O
- Mol. Weight (g/mol)
- 74.08
- CAS
- 79-20-9
- 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, methyl ester (1) [ref]
Operational condition: Pressure, kPa = 101 (Liquid)
| Temperature, K - Liquid | Mole fraction of Acetic acid, methyl ester (1) - Liquid |
|---|---|
| 279.10 | 0.0173 |
| 282.20 | 0.0180 |
| 285.30 | 0.0189 |
| 288.50 | 0.0195 |
| 291.30 | 0.0204 |
| 296.10 | 0.0220 |
| 301.00 | 0.0237 |
| 305.80 | 0.0261 |
| 310.70 | 0.0289 |
| 315.50 | 0.0321 |
Mole fraction of Simvastatin (2) [ref]
Operational condition: Pressure, kPa = 101 (Liquid)
| Temperature, K - Liquid | Mole fraction of Simvastatin (2) - Liquid |
|---|---|
| 278.15 | 0.0241 |
| 283.15 | 0.0290 |
| 288.15 | 0.0339 |
| 293.15 | 0.0414 |
| 298.15 | 0.0503 |
| 303.15 | 0.0608 |
| 308.15 | 0.0765 |
| 313.15 | 0.0949 |
| 318.15 | 0.1122 |
Mole fraction of Acetic acid, methyl ester (1) [ref]
Operational condition: Pressure, kPa = 101 (Liquid)
| Temperature, K - Liquid | Mole fraction of Acetic acid, methyl ester (1) - Liquid |
|---|---|
| 279.10 | 0.0173 |
| 282.20 | 0.0180 |
| 285.30 | 0.0189 |
| 288.50 | 0.0195 |
| 291.30 | 0.0204 |
| 296.10 | 0.0220 |
| 301.00 | 0.0237 |
| 305.80 | 0.0261 |
| 310.70 | 0.0289 |
| 315.50 | 0.0321 |
Mole fraction of Simvastatin (2) [ref]
Operational condition: Pressure, kPa = 101 (Liquid)
| Temperature, K - Liquid | Mole fraction of Simvastatin (2) - Liquid |
|---|---|
| 278.15 | 0.0241 |
| 283.15 | 0.0290 |
| 288.15 | 0.0339 |
| 293.15 | 0.0414 |
| 298.15 | 0.0503 |
| 303.15 | 0.0608 |
| 308.15 | 0.0765 |
| 313.15 | 0.0949 |
| 318.15 | 0.1122 |