Papa, E.; Villa, F.; Gramatica, P. Statistically Validated QSARs, Based on Theoretical Descriptors, for Modeling Aquatic Toxicity of Organic Chemicals in Pimephales promelas (Fathead Minnow). J. Chem. Inf. Model. 2005, 45, 5, 1256–1266.

Compound

	ID:	109
	Name:	Benzaldehyde
	Description:
	Labels:
	CAS:	100-52-7
	InChi Code:	InChI=1S/C7H6O/c8-6-7-4-2-1-3-5-7/h1-6H

Properties

pLC50: 96-h Fathead minnow toxicity as log(1/LC50) [log(L/mmol)]

Value	Source or prediction
4.032	experimental value
3.281	Eq9: General validated correlation, logP free (Training set)

Links to External Resources

Link	Resource description
DTXSID8039241	US EPA CompTox Dashboard