| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 6YS6J4URT3 |
| EPA CompTox | DTXSID1061283 |
Structure
| InChI Key | FZIBCCGGICGWBP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H10O2 |
| Molecular Weight | 114.07 |
| AlogP | 1.13 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 924-50-5 |
| NORMAN SUSDAT | |
| FDA SRS | 6YS6J4URT3 |
| PubChem | 13546 |
| ChemSpider | 12958.0 |
CONTENTS
