Base information
| Cat. No. | |
| CAS No. | 745830-14-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H8ClNO3 |
| Molecular Weight | 249.65 |
| Exact Mass | 249.019 |
| XLogP3 | 2.626 |
| Mr | 63.6395 |
| PSA | 56.26 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 26 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | O=Cc1cc2ccc(cc2nc1Cl)OC(=O)C |
