HuagongsheHuagongshe Chemistry Print Report · For research reference only
1-Iododotetracontane
Identifiers & Physical Properties
| CAS No. | 76665-60-6 |
|---|---|
| Molecular formula | C42H85I |
| Average molar mass | 717 g/mol |
| Monoisotopic mass | 716.5696 g/mol |
| SMILES | CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCI |
| InChIKey | YOAIMQAQDYHMDD-UHFFFAOYSA-N |
| PubChem CID | 12696147 |
| DTXSID | DTXSID301315366 |
Chemical & Physical Properties
| XLogP | 23.7 |
|---|---|
| Topological polar surface area | 0 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 0 |
| Rotatable bonds | 40 |
| Heavy atoms | 43 |
| Formal charge | 0 |
| Complexity | 446 |