Base information
| Cat. No. | |
| CAS No. | 100-18-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H18 |
| Molecular Weight | 162.271 |
| Exact Mass | 162.141 |
| XLogP3 | 3.9334 |
| Mr | 55.602 |
| PSA | 0 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 30 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CC(c1ccc(cc1)C(C)C)C |
