Base information
| Cat. No. | |
| CAS No. | 133409-72-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H12BrNO3 |
| Molecular Weight | 286.122 |
| Exact Mass | 285 |
| XLogP3 | 2.105 |
| Mr | 64.72 |
| PSA | 47.89 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 28 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | CO/N=C(\c1ccccc1CBr)/C(=O)OC |
