| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 4TK5QAZ92W |
| EPA CompTox | DTXSID40870800 |
Structure
| InChI Key | XDHOEHJVXXTEDV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H10O |
| Molecular Weight | 86.07 |
| AlogP | 1.56 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 6.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 928-55-2 |
| NORMAN SUSDAT | |
| FDA SRS | 4TK5QAZ92W |
| PubChem | 13570 |
CONTENTS
