| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | YWV817MXF3 |
| EPA CompTox | DTXSID7027598 |
Structure
| InChI Key | NHDIQVFFNDKAQU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9H21B1O3 |
| Molecular Weight | 188.16 |
| AlogP | 2.25 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 27.69 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 5419-55-6 |
| NORMAN SUSDAT | |
| FDA SRS | YWV817MXF3 |
| PubChem | 21531 |
| ChemSpider | 20236.0 |
CONTENTS
