Base information
| Cat. No. | |
| CAS No. | 123158-31-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H8F3NO3 |
| Molecular Weight | 271.192 |
| Exact Mass | 271.046 |
| XLogP3 | 2.3335 |
| Mr | 60.8502 |
| PSA | 59.16 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 28 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1cc(=O)c2c([nH]1)ccc(c2)C(F)(F)F |
