| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 8Z1ME41SCH |
| EPA CompTox | DTXSID20156639 |
Structure
| InChI Key | KTMKRRPZPWUYKK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C1H5B1O2 |
| Molecular Weight | 60.04 |
| AlogP | -0.91 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Polar Surface Area | 40.46 |
| Heavy Atoms | 4.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 13061-96-6 |
| NORMAN SUSDAT | |
| FDA SRS | 8Z1ME41SCH |
CONTENTS
