Base information
| Cat. No. | |
| CAS No. | 80791-79-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H4BrNO2 |
| Molecular Weight | 189.995 |
| Exact Mass | 188.943 |
| XLogP3 | 0.843 |
| Mr | 36.7857 |
| PSA | 53.09 |
| Sequence | - |
| Atom number | 13 |
| Bond number | 13 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Brc1c[nH]c(=O)cc1O |
