10967/165 - QDB Compounds

QsarDB Repository

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:Tab1-19
Name:3,4,5-Trimethoxyphenol
Description:
Labels:
CAS:
InChi Code:InChI=1S/C9H12O4/c1-11-7-4-6(10)5-8(12-2)9(7)13-3/h4-5,10H,1-3H3

Properties

E7: Redox potential [V] i

ValueSource or prediction
0.66

experimental value

0.61

Eq4: Model for phenoxyl radicals with 3 descriptors (Training set)

0.61

Eq6: Model for phenoxyl radicals with 4 descriptors (Training set)

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