Lien, E. J.; Ren, S.; Bui, H.-H.; Wang, R. Quantitative structure-activity relationship analysis of phenolic antioxidants. Free Radic. Biol. Med. 1999, 26, 285–294.
Compound
| ID: | Tab1-6 | |
|---|---|---|
| Name: | Phenol | |
| Description: | ||
| Labels: | ||
| CAS: | ||
| InChi Code: | InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H |
Properties
E7: Redox potential [V] i
| Value | Source or prediction |
|---|---|
| 0.97 |
experimental value |
| 0.96 |
Eq4: Model for phenoxyl radicals with 3 descriptors (Training set) |
| 0.92 |
Eq6: Model for phenoxyl radicals with 4 descriptors (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID5021124 | US EPA CompTox Dashboard |