Base information
| Cat. No. | |
| CAS No. | 1261394-62-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H9ClF3NO2 |
| Molecular Weight | 321.631 |
| Exact Mass | 321.048 |
| XLogP3 | 4.2111 |
| Mr | 73.1827 |
| PSA | 38.33 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 32 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | FC([C@@]1(C#CC2CC2)OC(=O)N[13c]2[13c]1[13cH][13c](Cl)[13cH][13cH]2)(F)F |
