Base information
| Cat. No. | |
| CAS No. | 181585-07-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H10BrNO2 |
| Molecular Weight | 232.074 |
| Exact Mass | 230.989 |
| XLogP3 | 1.8693 |
| Mr | 49.128 |
| PSA | 31.35 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 22 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | COCCOc1cncc(c1)Br |
