10967/223 - QDB Compounds

QsarDB Repository

Tulp, I.; Tamm, T.; Karelson, G.; Dobchev, D.; Martin, D.; Tämm, K.; Savchenko, D.; Jänes, J.; Härk, E.; Kreegipuu, A.; Karelson, M. QSAR for abiotic degradation in air. Q13-22a-0034. Molcode Ltd., 2010.

Compound

ID:124
Name:methyl t-butyl ether
Description:
Labels:
CAS:1634-04-4
InChi Code:InChI=1S/C5H12O/c1-5(2,3)6-4/h1-4H3

Properties

logT(0.5): Degradation half-life in air [log(h)]

ValueSource or prediction
1.23

experimental value

0.894

QSAR: Model for degradation half-life (Training set)