Base information
| Cat. No. | |
| CAS No. | 1004558-41-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H14ClNO2 |
| Molecular Weight | 251.709 |
| Exact Mass | 251.071 |
| XLogP3 | 4.0779 |
| Mr | 69.15 |
| PSA | 31.23 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 32 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | Clc1cccc2c1n(cc2)C(=O)OC(C)(C)C |
