HuagongsheHuagongshe Chemistry Print Report · For research reference only
n-hexane EtOAc water
Identifiers & Physical Properties
| Molecular formula | C10H24O3 |
|---|---|
| Average molar mass | 192.3 g/mol |
| Monoisotopic mass | 192.17254462 g/mol |
| SMILES | CCCCCC.CCOC(C)=O.O |
| InChIKey | HELMCUDQQQWAOG-UHFFFAOYSA-N |
| PubChem CID | 86758607 |
Chemical & Physical Properties
| Topological polar surface area | 27.3 |
|---|---|
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 5 |
| Heavy atoms | 13 |
| Formal charge | 0 |
| Complexity | 61 |