Base information
| Cat. No. | |
| CAS No. | 6557-85-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H23BrO4 |
| Molecular Weight | 323.223 |
| Exact Mass | 322.078 |
| XLogP3 | 3.0742 |
| Mr | 75.045 |
| PSA | 52.6 |
| Sequence | - |
| Atom number | 41 |
| Bond number | 40 |
| Ring number | 0 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | BrCCCCCCC(C(=O)OCC)C(=O)OCC |
