Base information
| Cat. No. | |
| CAS No. | 100523-85-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H10O3 |
| Molecular Weight | 166.174 |
| Exact Mass | 166.063 |
| XLogP3 | 1.6528 |
| Mr | 45.1973 |
| PSA | 57.53 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 22 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CCc1ccc(cc1O)C(=O)O |
