HuagongsheHuagongshe Chemistry Print Report · For research reference only
cis-(-)-Stobadin dihydrochloride
Identifiers & Physical Properties
| CAS No. | 97571-51-2 |
|---|---|
| Molecular formula | C16H26O2 |
| Average molar mass | 250.38 g/mol |
| Monoisotopic mass | 250.19328007 g/mol |
| SMILES | C=C1CC[C@@H]2CCCC[C@H]2[C@@]1(C)CC(=O)OCC |
| InChIKey | BJPCXRRQWCYTEZ-LZWOXQAQSA-N |
| PubChem CID | 175708 |
| DTXSID | DTXSID00243051 |
Chemical & Physical Properties
| XLogP | 4.5 |
|---|---|
| Topological polar surface area | 26.3 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 4 |
| Heavy atoms | 18 |
| Formal charge | 0 |
| Complexity | 334 |