Schultz, T.W.; Netzeva, T.I.; Roberts, D.W.; Cronin, M.T.D. Structure-Toxicity Relationships for the Effects to Tetrahymena pyriformis of Aliphatic, Carbonyl-Containing, α,β-Unsaturated Chemicals. Chem. Res. Toxicol. 2005, 18, 2, 330–341.

Compound

	ID:	78
	Name:	methyl-2-octynoate
	Description:
	Labels:
	CAS:	111-12-6
	InChi Code:

Properties

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

Value	Source or prediction
1.043	experimental value
0.606	1: Aliphatic compounds (Training)
1.065	10: Ethynylene-containing esters (Training)