HuagongsheHuagongshe Chemistry Print Report · For research reference only
4-Benzyloxy-6-methyl-2H-pyran-2-one

Identifiers & Physical Properties
| CAS No. | 61424-86-0 |
|---|---|
| Molecular formula | C13H12O3 |
| Average molar mass | 216.23 g/mol |
| Monoisotopic mass | 216.07864424 g/mol |
| SMILES | Cc1cc(OCc2ccccc2)cc(=O)o1 |
| InChIKey | LSIQTDFHMYCEHC-UHFFFAOYSA-N |
| PubChem CID | 2784449 |
| DTXSID | DTXSID50382762 |
Chemical & Physical Properties
| XLogP | 2.3 |
|---|---|
| Topological polar surface area | 35.5 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 3 |
| Heavy atoms | 16 |
| Formal charge | 0 |
| Complexity | 322 |