Base information
| Cat. No. | |
| CAS No. | 116511-28-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H14BrNO2 |
| Molecular Weight | 260.128 |
| Exact Mass | 259.021 |
| XLogP3 | 1.3207 |
| Mr | 63.893 |
| PSA | 29.54 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 27 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CN1CC(=CCC1)C(=O)OCC#C.Br |
