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:	889
	Name:	(anthracen-9-yl)methanol
	Description:	IUPAC names and InChI codes were generated with InstantJChem Original name was: 9-Anthracenemethanol
	Labels:
	CAS:	1468-95-7
	InChi Code:	InChI=1S/C15H12O/c16-10-15-13-7-3-1-5-11(13)9-12-6-2-4-8-14(12)15/h1-9,16H,10H2

Properties

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

Value	Source or prediction
3.61	experimental value
3.4901	Tab2.Model_2: logKoc (Training set)

Links to External Resources

Link	Resource description
DTXSID1049221	US EPA CompTox Dashboard