Base information
| Cat. No. | |
| CAS No. | 15109-94-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H5BrO2 |
| Molecular Weight | 189.007 |
| Exact Mass | 187.947 |
| XLogP3 | 1.8572 |
| Mr | 36.7725 |
| PSA | 30.21 |
| Sequence | - |
| Atom number | 14 |
| Bond number | 14 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | BrCC(=O)c1ccco1 |
