Schultz, T.W.; Carlson, R.E.; Cronin, M.T.D.; Hermens, J.L.M.; Johnson, R.; O’Brien, P.J.; Roberts, D.W.; Siraki, A.; Wallace, K.B.; Veith, G.D. A conceptual framework for predicting the toxicity of reactive chemicals: modeling soft electrophilicity. SAR QSAR Environ. Res. 2006, 17, 413–428.

Compound

	ID:	9
	Name:	4-Methyl-3-penten-2-one
	Description:
	Labels:	Training
	CAS:	141-79-7
	InChi Code:	InChI=1S/C6H10O/c1-5(2)4-6(3)7/h4H,1-3H3

Properties

logRD50: Respiratory sensitisation as logarithm of toxicity

Value	Source or prediction
1.79	experimental value
1.8971	Tbl.4: Michael acceptors as respiratory irritants (Training set)

Links to External Resources

Link	Resource description
DTXSID1029170	US EPA CompTox Dashboard