Base information
| Cat. No. | |
| CAS No. | 85-42-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H10O3 |
| Molecular Weight | 154.163 |
| Exact Mass | 154.063 |
| XLogP3 | 0.8762 |
| Mr | 37.827 |
| PSA | 43.37 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O=C1OC(=O)C2C1CCCC2 |
