Furuhama, A.; Hasunuma, K.; Aoki, Y. Interspecies quantitative structure–activity–activity relationships (QSAARs) for prediction of acute aquatic toxicity of aromatic amines and phenols. SAR QSAR Environ. Res. 2015, 26, 301–323.

Compound

	ID:	G
	Name:	3-fluoroaniline
	Description:
	Labels:
	CAS:	372-19-0
	InChi Code:	InChI=1S/C6H6FN/c7-5-2-1-3-6(8)4-5/h1-4H,8H2

Properties

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

Value	Source or prediction
0.87	experimental value
1.61	Eq.3: Model for aromatic amines and phenols (fish) (Validation set)

pEC50: 72-h acute algae toxicity as log(1/EC50) [-log(mmol/L)]

Value	Source or prediction
0.37	experimental value
1.27	Eq.4: Model for aromatic amines and phenols (algae) (Validation set)

Links to External Resources

Link	Resource description
DTXSID10190683	US EPA CompTox Dashboard