| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | VY79R3SU8X |
| EPA CompTox | DTXSID60872846 |
Structure
| InChI Key | SATICYYAWWYRAM-VNKDHWASSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H10O1 |
| Molecular Weight | 110.07 |
| AlogP | 1.71 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4313-03-5 |
| NORMAN SUSDAT | |
| FDA SRS | VY79R3SU8X |
| PubChem | 5283321 |
| ChemSpider | 4446442.0 |
CONTENTS
