| Keyword(s): | Plastic additives ; Food Contact Chemicals ; Industrial Chemicals |
| Molecule Category | Free-form |
| UNII | 7BO8G1BYQU |
| EPA CompTox | DTXSID5045178 |
Structure
| InChI Key | HCZKYJDFEPMADG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C18H22O4 |
| Molecular Weight | 302.15 |
| AlogP | 3.57 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 80.92 |
| Heavy Atoms | 22.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 27686-84-6 |
| NORMAN SUSDAT | |
| FDA SRS | 7BO8G1BYQU |
| PubChem | 4534 |
| ChemSpider | 4375.0 |
CONTENTS
