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:	662
	Name:	1-amino-2-methyl-9,10-dihydroanthracene-9,10-dione
	Description:	IUPAC names and InChI codes were generated with InstantJChem Original name was: 1-Amino-2-methyl-9,10-Anthracenedione
	Labels:
	CAS:	82-28-0
	InChi Code:	InChI=1S/C15H11NO2/c1-8-6-7-11-12(13(8)16)15(18)10-5-3-2-4-9(10)14(11)17/h2-7H,16H2,1H3

Properties

M2.logKoc: Soil sorption coefficient as log(Koc) i

Value	Source or prediction
3.9	experimental value
2.6381	Tab2.Model_2: logKoc (Training set)

Links to External Resources

Link	Resource description
DTXSID7020057	US EPA CompTox Dashboard