HuagongsheHuagongshe Chemistry Print Report · For research reference only
Hexyl iodoacetate
Identifiers & Physical Properties
| CAS No. | 5436-99-7 |
|---|---|
| Molecular formula | C8H15IO2 |
| Average molar mass | 270.11 g/mol |
| Monoisotopic mass | 270.01168 g/mol |
| SMILES | CCCCCCOC(=O)CI |
| InChIKey | XJOFYNWBVZSJJZ-UHFFFAOYSA-N |
| PubChem CID | 228708 |
| DTXSID | DTXSID70969458 |
Chemical & Physical Properties
| XLogP | 3.1 |
|---|---|
| Topological polar surface area | 26.3 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 7 |
| Heavy atoms | 11 |
| Formal charge | 0 |
| Complexity | 104 |