Base information
| Cat. No. | |
| CAS No. | 1318897-45-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H8BrNO |
| Molecular Weight | 238.081 |
| Exact Mass | 236.979 |
| XLogP3 | 2.4896 |
| Mr | 55.5708 |
| PSA | 33.12 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OCc1ncc2c(c1)ccc(c2)Br |
