| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
Structure
| InChI Key | HTMLLPBZMWBCDN-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H9NO |
| Molecular Weight | 99.07 |
| AlogP | 1.25 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 32.59 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 51761-72-9 |
| NORMAN SUSDAT | |
| PubChem | 95765 |
CONTENTS
