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:102
Name:2,3,3',4',5'-pentachlorobiphenyl
Description:Structure (mol-file) matches with CAS but not with the name
Labels:
CAS:25429-29-2
InChi Code:InChI=1S/C12H5Cl5/c13-8-3-1-2-7(11(8)16)6-4-9(14)12(17)10(15)5-6/h1-5H

Properties

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

ValueSource or prediction
3.23

experimental value

2.88

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