| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | N9B5ZQ67R5 |
| EPA CompTox | DTXSID70870934 |
Structure
| InChI Key | DUCKXCGALKOSJF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H18O3 |
| Molecular Weight | 186.13 |
| AlogP | 2.44 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 43.37 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2082-59-9 |
| NORMAN SUSDAT | |
| FDA SRS | N9B5ZQ67R5 |
| PubChem | 74959 |
CONTENTS
