Base information
| Cat. No. | |
| CAS No. | 1356861-54-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H19BrOS |
| Molecular Weight | 303.258 |
| Exact Mass | 302.034 |
| XLogP3 | 5.082 |
| Mr | 76.0215 |
| PSA | 45.31 |
| Sequence | - |
| Atom number | 35 |
| Bond number | 35 |
| Ring number | 1 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | CCCCC(Cc1cc(sc1Br)C=O)CC |
