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:	1579
	Name:	2,4,5,7-tetranitro-9H-fluoren-9-one
	Description:	IUPAC names and InChI codes were generated with InstantJChem Original name was: 2,4,5,7-Tetra-nitro-9-fluorenone The representation of nitro groups was fixed
	Labels:
	CAS:	746-53-2
	InChi Code:	InChI=1S/C13H4N4O9/c18-13-7-1-5(14(19)20)3-9(16(23)24)11(7)12-8(13)2-6(15(21)22)4-10(12)17(25)26/h1-4H

Properties

M8.logTA100: The mutagenicity potency in TA100 (without the S9 activation system) as log(TA100)

Value	Source or prediction
2.46	experimental value
3.1234	Tab2.Model_8: NitroPAH TA100 without S9 (Training set)

Links to External Resources

Link	Resource description
DTXSID7061067	US EPA CompTox Dashboard