Benigni, R.; Conti, L.; Crebelli, R.; Rodomonte, A.; Vari’, M. R. Simple and α,β-unsaturated aldehydes: Correct prediction of genotoxic activity through structure-activity relationship models. Environ. Mol. Mutagen. 2005, 46, 268–280.

Compound

	ID:	Tab3_18
	Name:	2-Hexenal
	Description:
	Labels:
	CAS:	6728-26-3
	InChi Code:	InChI=1S/C6H10O/c1-2-3-4-5-6-7/h4-6H,2-3H2,1H3/b5-4+

Properties

logTA100: Mutagenic potency in strain TA100 [log(revertants/umol)]

Value	Source or prediction
2.99	experimental value
2.84	Eq3: Model for mutagenicityof α,β‐unsaturated aldehydes (Training set)

Mutagenicity: Mutagenic class

Value	Source or prediction
active	experimental value
active	Eq2: Mutagenic classification of α,β‐unsaturated aldehydes (Training set)