HuagongsheHuagongshe Chemistry Print Report · For research reference only
2,4,6-Trichloro-5-propylbenzene-1,3-diol
Identifiers & Physical Properties
| CAS No. | 88207-83-4 |
|---|---|
| Molecular formula | C9H9Cl3O2 |
| Average molar mass | 255.5 g/mol |
| Monoisotopic mass | 253.96681257 g/mol |
| SMILES | CCCc1c(Cl)c(O)c(Cl)c(O)c1Cl |
| InChIKey | ZHOFUWJJODRRHZ-UHFFFAOYSA-N |
| PubChem CID | 71410051 |
| DTXSID | DTXSID40829752 |
Chemical & Physical Properties
| XLogP | 4.4 |
|---|---|
| Topological polar surface area | 40.5 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 2 |
| Heavy atoms | 14 |
| Formal charge | 0 |
| Complexity | 175 |