| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 384YJ7FK35 |
| EPA CompTox | DTXSID8065797 |
| InChI Key | AJUWUYJULVYGRA-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C14H30O2 |
| Molecular Weight | 230.22 |
| AlogP | 4.53 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 12.0 |
| Polar Surface Area | 18.46 |
| Heavy Atoms | 16.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 14620-52-1 |
| NORMAN SUSDAT | |
| FDA SRS | 384YJ7FK35 |
| PubChem | 84559 |
| ChemSpider | 76281.0 |