Base information
| Cat. No. | |
| CAS No. | 1451254-94-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H12BrNO4 |
| Molecular Weight | 338.153 |
| Exact Mass | 336.995 |
| XLogP3 | -1.5772 |
| Mr | 77.3656 |
| PSA | 78.48 |
| Sequence | - |
| Atom number | 32 |
| Bond number | 32 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1ccc(cc1)C[n+]1ccc(cc1)C(=O)O.[Br-] |
