Base information
| Cat. No. | |
| CAS No. | 1417353-80-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H5F3O3 |
| Molecular Weight | 218.129 |
| Exact Mass | 218.019 |
| XLogP3 | 2.2466 |
| Mr | 42.8945 |
| PSA | 35.53 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=Cc1cc2OCOc2c(c1)C(F)(F)F |
