Base information
| Cat. No. | |
| CAS No. | 1072952-39-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H6BClFNO2 |
| Molecular Weight | 189.38 |
| Exact Mass | 189.016 |
| XLogP3 | -0.1377 |
| Mr | 43.9966 |
| PSA | 53.35 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OB(c1c(C)cnc(c1F)Cl)O |
