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:Tab1-17
Name:2-Methoxy-4-methylphenol
Description:
Labels:
CAS:
InChi Code:InChI=1S/C8H10O2/c1-6-3-4-7(9)8(5-6)10-2/h3-5,9H,1-2H3

Properties

E7: Redox potential [V] i

ValueSource or prediction
0.68

experimental value

0.68

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

0.69

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

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