Base information
| Cat. No. | |
| CAS No. | 21440-97-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H10BrNO2 |
| Molecular Weight | 256.096 |
| Exact Mass | 254.989 |
| XLogP3 | 3.3843 |
| Mr | 60.4057 |
| PSA | 38.33 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 25 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O=C1Nc2ccc(cc2C(O1)(C)C)Br |
