Base information
| Cat. No. | |
| CAS No. | 1000017-98-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H4BrClN2O2 |
| Molecular Weight | 275.487 |
| Exact Mass | 273.914 |
| XLogP3 | 2.4484 |
| Mr | 54.8613 |
| PSA | 54.6 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 19 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Clc1cn2cc(nc2c(c1)Br)C(=O)O |
