| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | UJ99D58FBB |
| EPA CompTox | DTXSID6066288 |
Structure
| InChI Key | XAZAHJGDOHGFBV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H13N1O1 |
| Molecular Weight | 127.1 |
| AlogP | 1.45 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 44.02 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 17976-80-6 |
| NORMAN SUSDAT | |
| FDA SRS | UJ99D58FBB |
| PubChem | 87385 |
| ChemSpider | 78823.0 |
CONTENTS
