HuagongsheHuagongshe Chemistry Print Report · For research reference only
(+/-)-5-Pivaloylpentan-1,3,5-triol
Identifiers & Physical Properties
| Molecular formula | C10H20O4 |
|---|---|
| Average molar mass | 204.26 g/mol |
| Monoisotopic mass | 204.13615911 g/mol |
| SMILES | CC(C)(C)C(=O)C(O)CC(O)CCO |
| InChIKey | APBNGAIHJMCSAJ-UHFFFAOYSA-N |
| PubChem CID | 87775813 |
Chemical & Physical Properties
| XLogP | 0.1 |
|---|---|
| Topological polar surface area | 77.8 |
| Hydrogen bond donors | 3 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 6 |
| Heavy atoms | 14 |
| Formal charge | 0 |
| Complexity | 183 |