Franke, R.; Gruska, A.; Giuliani, A.; Benigni, R. Prediction of rodent carcinogenicity of aromatic amines: a quantitative structure-activity relationships model. Carcinogenesis 2001, 22, 1561–1571.

Compound

	ID:	61
	Name:	3,3'-Dimethoxybenzidine dihydrochloride
	Description:	Changed name from the original 3,3'-Dimethoxybenzidine · 2HCl to 3,3'-Dimethoxybenzidine dihydrochloride. The authors most likely used the cation for the calculations.
	Labels:
	CAS:	20325-40-0
	InChi Code:	InChI=1S/C14H16N2O2.2ClH/c1-17-13-7-9(3-5-11(13)15)10-4-6-12(16)14(8-10)18-2;;/h3-8H,15-16H2,1-2H3;2*1H

Properties

Carcinogenicity: Class: C - Carcinogenic, nC -non-Carcinogenic

Value	Source or prediction
C	experimental value
C	Eq.5: Carcinogenic class of aromatic amines (Training set.)

Potency: Carcinogenic potency as log(MW/TD50) [log((mol/kg)/TD50)]

Value	Source or prediction
29.946611	experimental value

Links to External Resources

Link	Resource description
DTXSID1020485	US EPA CompTox Dashboard