Base information
| Cat. No. | |
| CAS No. | 1207448-58-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H17BrO3 |
| Molecular Weight | 301.176 |
| Exact Mass | 300.036 |
| XLogP3 | 3.5388 |
| Mr | 72.2495 |
| PSA | 46.53 |
| Sequence | - |
| Atom number | 34 |
| Bond number | 34 |
| Ring number | 1 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | BrCCCCCCOc1ccc(c(c1)O)C=O |
