HuagongsheHuagongshe Chemistry Print Report · For research reference only
Ethyl 2-(4-Methyl-3-Pentenyl)-3-Hydroxybutyrate

Identifiers & Physical Properties
| Molecular formula | C12H22O3 |
|---|---|
| Average molar mass | 214.3 g/mol |
| Monoisotopic mass | 214.15689456 g/mol |
| SMILES | CCOC(=O)C(CCC=C(C)C)C(C)O |
| InChIKey | RQAIVCVGFVDBBA-UHFFFAOYSA-N |
| PubChem CID | 19829010 |
Chemical & Physical Properties
| XLogP | 2.5 |
|---|---|
| Topological polar surface area | 46.5 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 7 |
| Heavy atoms | 15 |
| Formal charge | 0 |
| Complexity | 217 |