Ellison, C.M.; Cronin, M.T.D.; Madden, J.C.; Schultz, T.W. Definition of the structural domain of the baseline non-polar narcosis model for Tetrahymena pyriformis. SAR QSAR Environ. Res. 2008, 19, 7-8, 751–783.

Compound

	ID:	493
	Name:	5-Methyl-5-hexen-2-one
	Description:	InChI code was generated with Jchem for Excel
	Labels:	Unsat., aliphatic, ketone
	CAS:	3240-09-3
	InChi Code:	InChI=1S/C7H12O/c1-6(2)4-5-7(3)8/h1,4-5H2,2-3H3

Properties

pIGC50: 40-h Tetrahymena toxicity as log(1/IGC50) [log(L/mmol)]

Value	Source or prediction
-0.87	experimental value
-0.72	Eq2: Saturated alcohols and ketones (Test set)

Links to External Resources

Link	Resource description
DTXSID5062928	US EPA CompTox Dashboard