| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | P577F6494A |
| EPA CompTox | DTXSID6041420 |
Structure
| InChI Key | SMNDYUVBFMFKNZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H4O3 |
| Molecular Weight | 112.02 |
| AlogP | 0.98 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 50.44 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 88-14-2 |
| NORMAN SUSDAT | |
| FDA SRS | P577F6494A |
| PubChem | 6919 |
| ChemSpider | 4573796.0 |
CONTENTS
