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:Tab3-4
Name:2,2,8-Trimethyl-6-chromanol
Description:
Labels:
CAS:
InChi Code:InChI=1S/C12H16O2/c1-8-6-10(13)7-9-4-5-12(2,3)14-11(8)9/h6-7,13H,4-5H2,1-3H3

Properties

Log(ksx10^3): Logarithm of second-order rate constant [Log(M-1 S-1)] i

ValueSource or prediction
0

experimental value

0.02

Eq12: Model for vitamin E derivatives (Training set)