HuagongsheHuagongshe Chemistry Print Report · For research reference only
Ethyl 2-benzoylpent-4-ynoate

Identifiers & Physical Properties
| Molecular formula | C14H14O3 |
|---|---|
| Average molar mass | 230.26 g/mol |
| Monoisotopic mass | 230.0942943 g/mol |
| SMILES | C#CCC(C(=O)OCC)C(=O)c1ccccc1 |
| InChIKey | LXCDLPDPVLFZGQ-UHFFFAOYSA-N |
| PubChem CID | 11009766 |
Chemical & Physical Properties
| XLogP | 2.6 |
|---|---|
| Topological polar surface area | 43.4 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 6 |
| Heavy atoms | 17 |
| Formal charge | 0 |
| Complexity | 318 |