Benigni, R.; Bossa, C.; Netzeva, T. I.; Rodomonte, A.; Tsakovska, I. Mechanistic QSAR of aromatic amines: New models for discriminating between homocyclic mutagens and nonmutagens, and validation of models for carcinogens. Environ. Mol. Mutagen. 2007, 48, 754–771.
Compound
| ID: | 83 | |
|---|---|---|
| Name: | 4,4'-Methylenebis(2-methyl-6-t-butylaniline) | |
| Description: | ||
| Labels: | ||
| CAS: | 13680-36-9 | |
| InChi Code: | InChI=1S/C23H34N2/c1-14-9-16(12-18(20(14)24)22(3,4)5)11-17-10-15(2)21(25)19(13-17)23(6,7)8/h9-10,12-13H,11,24-25H2,1-8H3 |
Properties
TA100: Mutagenicity for strain TA100 + S9 metabolism [[lg(revertants/nmol)]]
| Value | Source or prediction |
|---|---|
| -100 |
experimental value |
Mutagenicity: Mutagenic class
| Value | Source or prediction |
|---|---|
| nM |
experimental value |
| nM |
Eq8ter: Mutagenic class of homocyclic aromatic amines (Mutagenic class. M - mutagenic; nM - non-mutagenic) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID30159934 | US EPA CompTox Dashboard |