HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-(3-Oxo-cyclohexyl)-propionic acid ethyl ester
Identifiers & Physical Properties
| Molecular formula | C11H18O3 |
|---|---|
| Average molar mass | 198.26 g/mol |
| Monoisotopic mass | 198.12559443 g/mol |
| SMILES | CCOC(=O)CCC1CCCC(=O)C1 |
| InChIKey | CPVMRWMCDFCQMZ-UHFFFAOYSA-N |
| PubChem CID | 10856445 |
Chemical & Physical Properties
| XLogP | 1.4 |
|---|---|
| Topological polar surface area | 43.4 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 5 |
| Heavy atoms | 14 |
| Formal charge | 0 |
| Complexity | 211 |