HuagongsheHuagongshe Chemistry Print Report · For research reference only
1,1'-(Hexane-1,6-diyl)di(azepan-2-one)
Identifiers & Physical Properties
| CAS No. | 4190-19-6 |
|---|---|
| Molecular formula | C18H32N2O2 |
| Average molar mass | 308.5 g/mol |
| Monoisotopic mass | 308.24637827 g/mol |
| SMILES | O=C1CCCCCN1CCCCCCN1CCCCCC1=O |
| InChIKey | CUIOHEDSSBSZPE-UHFFFAOYSA-N |
| PubChem CID | 71361908 |
| DTXSID | DTXSID50785557 |
Chemical & Physical Properties
| XLogP | 2.2 |
|---|---|
| Topological polar surface area | 40.6 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 7 |
| Heavy atoms | 22 |
| Formal charge | 0 |
| Complexity | 323 |