| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID30167812 |
Structure
| InChI Key | VACPZDQXUAOTFR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H19N1 |
| Molecular Weight | 129.15 |
| AlogP | 2.17 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 12.03 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 16486-74-1 |
| NORMAN SUSDAT | |
| PubChem | 85447 |
| ChemSpider | 77061.0 |
CONTENTS
