| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | T955W3JLU9 |
| EPA CompTox | DTXSID90196188 |
Structure
| InChI Key | CAOQEOHEZKVYOJ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H17N |
| Molecular Weight | 127.14 |
| AlogP | 1.92 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 26.02 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4448-77-5 |
| NORMAN SUSDAT | |
| FDA SRS | T955W3JLU9 |
| PubChem | 78194 |
CONTENTS
