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| IUPAC Name: | methyl 2-propan-2-ylpentanoate |
| Description: | rac 2-Isopropyl Pentanoic Acid Methyl Ester is the methyl ester derivative of rac 2-Isopropyl Pentanoic Acid (I872870); a constitutional isomer of Valproic Acid (V094750) which is a potent anticonvulsant. |
| Molecular Weight: | 158.24 |
| Molecular Formula: | C9H18O2 |
| Canonical SMILES: | CCCC(C(C)C)C(=O)OC |
| InChI: | InChI=1S/C9H18O2/c1-5-6-8(7(2)3)9(10)11-4/h7-8H,5-6H2,1-4H3 |
| InChI Key: | MMJRKPAFHAAWAU-UHFFFAOYSA-N |
| References: | Levy, R., et al. Pharm. Res., 8, 551 (1991); Barton, M., et al. Epilepsy Res., 47, 217 (2001); Fox, A., et al. Pain, 105, 355 (2003); Archer, D., et al. Anesth. Analg., 104, 180 (2007). |
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