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:	Tab1_18
	Name:	Phenol
	Description:
	Labels:
	CAS:	108-95-2
	InChi Code:	InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H

Properties

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

Value	Source or prediction
0.58	experimental value
0.46	Eq.3: Model for aromatic amines and phenols (fish) (Training set)

Links to External Resources

Link	Resource description
DTXSID5021124	US EPA CompTox Dashboard