Base information
| Cat. No. | |
| CAS No. | 177970-27-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H6BrNO3 |
| Molecular Weight | 256.053 |
| Exact Mass | 254.953 |
| XLogP3 | 1.5522 |
| Mr | 55.7707 |
| PSA | 63.07 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Cc1cc(Br)c2c(c1)c(=O)oc(=O)[nH]2 |
