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_15
	Name:	2-Butylacrolein
	Description:
	Labels:
	CAS:	1070-66-2
	InChi Code:	InChI=1S/C7H12O/c1-3-4-5-7(2)6-8/h6H,2-5H2,1H3

Properties

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

Value	Source or prediction
2.62	experimental value
1.85	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)