Base information
| Cat. No. | |
| CAS No. | 81189-61-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H24BrNO7 |
| Molecular Weight | 494.332 |
| Exact Mass | 493.074 |
| XLogP3 | 5.076 |
| Mr | 116.502 |
| PSA | 111.16 |
| Sequence | - |
| Atom number | 55 |
| Bond number | 56 |
| Ring number | 2 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | O=C(Oc1ccc(cc1)C[C@H](C(=O)O)NC(=O)OC(C)(C)C)OCc1ccccc1Br |
