Base information
| Cat. No. | |
| CAS No. | 15832-09-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H8O3 |
| Molecular Weight | 164.158 |
| Exact Mass | 164.047 |
| XLogP3 | 1.2703 |
| Mr | 42.6995 |
| PSA | 35.53 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | COc1ccc2c(c1)OCC2=O |
