| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | S64SQQ4UJR |
| EPA CompTox | DTXSID50198421 |
| InChI Key | KIYUNVUWDQKWPJ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C13H24O |
| Molecular Weight | 196.18 |
| AlogP | 4.11 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 14.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 5037-22-9 |
| NORMAN SUSDAT | |
| FDA SRS | S64SQQ4UJR |
| PubChem | 78737 |