| Keyword(s): | Food Contact Chemicals ; Indoor Environment Substances |
| Molecule Category | Free-form |
| UNII | 2KAG279R6R |
| EPA CompTox | DTXSID6020014 |
Structure
| InChI Key | PGRHXDWITVMQBC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H8O4 |
| Molecular Weight | 168.04 |
| AlogP | 0.22 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 60.44 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 520-45-6 |
| NORMAN SUSDAT | |
| FDA SRS | 2KAG279R6R |
| PubChem | 122903 |
| ChemSpider | 13887609.0 |
CONTENTS
