5-(戊烷-3-基氧基)-7-氧代-双环[4.1.0]庚-3-烯-3-羧酸乙酯 / 奥司他韦中间体 / 奥司他韦环氧物 / Oseltamivir intermediate / Oseltamivir epoxide / Ethyl (3R,4S,5S)-4,5-epoxy-3-(1-ethylpropoxy)cyclohex-1-ene-1-carboxylate / EEC epoxide / MFCD08063944
| Número CAS | 204254-96-6 |
|---|---|
| Código de producto | SL1112044 |
| Fórmula molecular | C14H22O4 |
| Masa molar | 254.32 |
| Aspecto | White to off-white solid |
| Punto de fusión | 56-57 °C |
| Punto de ebullición | 336.5±42.0 °C (predicted) |
| Densidad | 1.08±0.1 g/cm3 (predicted) |
| Solubilidad | Slightly soluble in chloroform and methanol |
| Rotación óptica específica | Consistent with structure |
| SMILES | CCC(CC)O[C@@H]1C=C(C[C@H]2[C@@H]1O2)C(=O)OCC |
| InChIKey | XZXCGRFGEVXWIT-FRRDWIJNSA-N |
| Descripción | A chiral epoxy ethyl carboxylate intermediate associated with oseltamivir synthesis, featuring a 7-oxabicyclo[4.1.0]heptene scaffold, epoxide motif, and ethyl ester functionality. |
| Aplicaciones | Primarily used as a pharmaceutical intermediate for oseltamivir/oseltamivir phosphate related synthesis, research, and process development. |