Gramatica, P.; Cassani, S.; Chirico, N. QSARINS-chem: Insubria datasets and new QSAR/QSPR models for environmental pollutants in QSARINS. J. Comput. Chem. 2014, 35, 1036–1044.

Compound

	ID:	623
	Name:	1,2,4-trichlorooxanthrene
	Description:	IUPAC names and InChI codes were generated with InstantJChem Original name was: 1.2.4-Trichlorodibenzo[b.e][1.4]dioxin
	Labels:
	CAS:	39227-58-2
	InChi Code:	InChI=1S/C12H5Cl3O2/c13-6-5-7(14)11-12(10(6)15)17-9-4-2-1-3-8(9)16-11/h1-5H

Properties

M3.GHLI: Global half-life index i

Value	Source or prediction
1.05847	experimental value
1.9155	Tab2.Model_3: Global half-life index (Training set)

M5.logHLn: Biotransformation half-lives in fish

Value	Source or prediction
0.430825461	experimental value
1.4231	Tab2.Model_5: Metab. biotransf. fish (Training set)

Links to External Resources

Link	Resource description
DTXSID50192489	US EPA CompTox Dashboard