| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
Structure
| InChI Key | JUAHIVUUUQRPLE-AATRIKPKSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H14O2 |
| Molecular Weight | 142.1 |
| AlogP | 2.06 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 37.3 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 60308-78-3 |
| NORMAN SUSDAT | |
| PubChem | 6437410 |
CONTENTS
