| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID501002703 |
Structure
| InChI Key | KNQXQZSRXRRCIZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H5NO3 |
| Molecular Weight | 127.03 |
| AlogP | -0.36 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 67.16 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 82469-78-1 |
| NORMAN SUSDAT | |
| PubChem | 16205353 |
CONTENTS
