HuagongsheHuagongshe Chemistry Print Report · For research reference only
1,1,1-Trifluoro-2-methyl-3-(4-benzoylphenoxy)propan-2-ol
Identifiers & Physical Properties
| Molecular formula | C17H15F3O3 |
|---|---|
| Average molar mass | 324.29 g/mol |
| Monoisotopic mass | 324.09732882 g/mol |
| SMILES | CC(O)(COc1ccc(C(=O)c2ccccc2)cc1)C(F)(F)F |
| InChIKey | TUSISESXZKDOMD-UHFFFAOYSA-N |
| PubChem CID | 19939322 |
Chemical & Physical Properties
| XLogP | 3.9 |
|---|---|
| Topological polar surface area | 46.5 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 6 |
| Rotatable bonds | 5 |
| Heavy atoms | 23 |
| Formal charge | 0 |
| Complexity | 396 |