Base information
| Cat. No. | |
| CAS No. | 16879-02-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H4ClNO |
| Molecular Weight | 129.544 |
| Exact Mass | 128.998 |
| XLogP3 | 1.0283 |
| Mr | 32.0727 |
| PSA | 32.86 |
| Sequence | - |
| Atom number | 12 |
| Bond number | 12 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Clc1cccc(=O)[nH]1 |