Base information
| Cat. No. | |
| CAS No. | 859937-44-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H12BrNO2 |
| Molecular Weight | 258.112 |
| Exact Mass | 257.005 |
| XLogP3 | 3.4341 |
| Mr | 60.0857 |
| PSA | 63.32 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 26 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CC(c1cc(N)c(cc1Br)C(=O)O)C |
