HuagongsheHuagongshe Chemistry Print Report · For research reference only
4-Chloro-3-pentadecylphenol
4-Chloro-3-pentadecylphenol
Identifiers & Physical Properties
| CAS No. | 6964-19-8 |
|---|---|
| Molecular formula | C21H35ClO |
| Average molar mass | 339 g/mol |
| Monoisotopic mass | 338.2376434 g/mol |
| SMILES | CCCCCCCCCCCCCCCc1cc(O)ccc1Cl |
| InChIKey | IGXPUAZPFOOSEE-UHFFFAOYSA-N |
| PubChem CID | 23402 |
| DTXSID | DTXSID90219902 |
Chemical & Physical Properties
| XLogP | 10 |
|---|---|
| Topological polar surface area | 20.2 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 1 |
| Rotatable bonds | 14 |
| Heavy atoms | 23 |
| Formal charge | 0 |
| Complexity | 256 |