| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | Z0420GYD84 |
| EPA CompTox | DTXSID6048468 |
Structure
| InChI Key | VSRBKQFNFZQRBM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H17N1 |
| Molecular Weight | 115.14 |
| AlogP | 1.91 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 26.02 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 123-82-0 |
| NORMAN SUSDAT | |
| FDA SRS | Z0420GYD84 |
| PubChem | 5603 |
| ChemSpider | 5401.0 |
CONTENTS
