Base information
| Cat. No. | |
| CAS No. | 30611-21-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H16O3 |
| Molecular Weight | 220.264 |
| Exact Mass | 220.11 |
| XLogP3 | 2.8461 |
| Mr | 62.337 |
| PSA | 43.37 |
| Sequence | - |
| Atom number | 32 |
| Bond number | 32 |
| Ring number | 1 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | CCCCC(=O)c1ccc(cc1)C(=O)OC |
