| Keyword(s): | Natural Toxins |
| Molecule Category | Free-form |
| UNII | 95X2BV4W8R |
| EPA CompTox | DTXSID2021101 |
Structure
| InChI Key | ZRWPUFFVAOMMNM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H6O4 |
| Molecular Weight | 154.03 |
| AlogP | -0.3 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 55.76 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 149-29-1 |
| NORMAN SUSDAT | |
| FDA SRS | 95X2BV4W8R |
| PubChem | 4696 |
| ChemSpider | 4534.0 |
CONTENTS
