Base information
| Cat. No. | |
| CAS No. | 1122089-67-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H15NO3 |
| Molecular Weight | 221.252 |
| Exact Mass | 221.105 |
| XLogP3 | 2.446 |
| Mr | 59.7683 |
| PSA | 59.42 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 32 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COc1nc(cc(c1)C(=O)O)C1CCCC1 |
