Base information
| Cat. No. | |
| CAS No. | 1261633-42-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H8ClNO3 |
| Molecular Weight | 201.607 |
| Exact Mass | 201.019 |
| XLogP3 | 1.3707 |
| Mr | 47.2838 |
| PSA | 59.42 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COc1nc(Cl)ccc1CC(=O)O |
