| Keyword(s): | Food Contact Chemicals ; Plastic additives |
| Molecule Category | Salt-form |
| UNII | 3QDE968MKD |
| EPA CompTox | DTXSID4044612 |
Structure
| InChI Key | NSQPPSOSXWOZNH-UHFFFAOYSA-L |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H6O2.1/2Ca |
| Molecular Weight | 282.02 |
| AlogP | -0.28 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 80.26 |
| Heavy Atoms | 19.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2090-05-3 |
| NORMAN SUSDAT | |
| FDA SRS | 3QDE968MKD |
CONTENTS
