Base information
| Cat. No. | |
| CAS No. | 625445-16-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H14O3 |
| Molecular Weight | 170.206 |
| Exact Mass | 170.094 |
| XLogP3 | 1.0191 |
| Mr | 45.2358 |
| PSA | 46.53 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 26 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CCCC(=O)O[C@H]1C[C@@H](C=C1)O |
