HuagongsheHuagongshe Chemistry Print Report · For research reference only
2-Iodo-5,5-dimethylcyclohex-2-en-1-one
Identifiers & Physical Properties
| Molecular formula | C8H11IO |
|---|---|
| Average molar mass | 250.08 g/mol |
| Monoisotopic mass | 249.98546 g/mol |
| SMILES | CC1(C)CC=C(I)C(=O)C1 |
| InChIKey | MUVOQKKVLCESII-UHFFFAOYSA-N |
| PubChem CID | 11368687 |
Chemical & Physical Properties
| XLogP | 2.4 |
|---|---|
| Topological polar surface area | 17.1 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 1 |
| Rotatable bonds | 0 |
| Heavy atoms | 10 |
| Formal charge | 0 |
| Complexity | 191 |