| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | NU7VS4JVC5 |
| EPA CompTox | DTXSID70183056 |
Structure
| InChI Key | RGXIXVNKYUAKHS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H10O1 |
| Molecular Weight | 110.07 |
| AlogP | 1.87 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2886-59-1 |
| NORMAN SUSDAT | |
| FDA SRS | NU7VS4JVC5 |
| PubChem | 76156 |
| ChemSpider | 68640.0 |
CONTENTS
