Base information
| Cat. No. | |
| CAS No. | 87853-68-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H10BrNO3 |
| Molecular Weight | 260.085 |
| Exact Mass | 258.984 |
| XLogP3 | 2.0294 |
| Mr | 54.5155 |
| PSA | 48.42 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 24 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)c1c(OC)ccnc1Br |
