HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-(2-Cyclopentylphenoxy)-1,2-propanediol
Identifiers & Physical Properties
| CAS No. | 114828-91-0 |
|---|---|
| Molecular formula | C14H20O3 |
| Average molar mass | 236.31 g/mol |
| Monoisotopic mass | 236.1412445 g/mol |
| SMILES | OCC(O)COc1ccccc1C1CCCC1 |
| InChIKey | PGDWHNSQWORASA-UHFFFAOYSA-N |
| PubChem CID | 150607 |
| DTXSID | DTXSID10921510 |
Chemical & Physical Properties
| XLogP | 2.9 |
|---|---|
| Topological polar surface area | 49.7 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 5 |
| Heavy atoms | 17 |
| Formal charge | 0 |
| Complexity | 214 |