Base information
| Cat. No. | |
| CAS No. | 85740-98-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H7ClO3 |
| Molecular Weight | 186.592 |
| Exact Mass | 186.008 |
| XLogP3 | 2.0468 |
| Mr | 44.9033 |
| PSA | 46.53 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1cc(ccc1Cl)C(=O)O |
