| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 4750GDF6TN |
| EPA CompTox | DTXSID60193725 |
Structure
| InChI Key | MQSXUKPGWMJYBT-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H14O1 |
| Molecular Weight | 150.1 |
| AlogP | 2.73 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4074-43-5 |
| NORMAN SUSDAT | |
| FDA SRS | 4750GDF6TN |
| PubChem | 19994 |
| ChemSpider | 18835.0 |
CONTENTS
