Pérez-Garrido, A.; Helguera, A. M.; López, G. C.; Cordeiro, M. N. D. S.; Escudero, A. G. A topological substructural molecular design approach for predicting mutagenesis end-points of α, β-unsaturated carbonyl compounds. Toxicology 2010, 268, 64–77.

Compound

	ID:	71
	Name:	3-chloro-4-(dichloromethyl)-5-methoxy-2(5H)-furanone
	Description:
	Labels:
	CAS:	97055-38-4
	InChi Code:	InChI=1S/C6H5Cl3O3/c1-11-6-2(4(8)9)3(7)5(10)12-6/h4,6H,1H3

Properties

AMES: Ames test mutagenicity class

Value	Source or prediction
mutagen	experimental value
mutagen	Eq6: Model for α,β-unsaturated carbonyl compounds (Training set)