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_12
	Name:	2-Chloro-3,3-dimethylacrolein
	Description:
	Labels:
	CAS:	7364-09-2
	InChi Code:	InChI=1S/C5H7ClO/c1-4(2)5(6)3-7/h3H,1-2H3

Properties

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

Value	Source or prediction
4.63	experimental value
5.13	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)