N-[2-(4-tert-butylphenoxy)ethyl]-2-nitro-4-(trifluoromethanesulfonyl)aniline
Chemical Structure Depiction of
N-[2-(4-tert-butylphenoxy)ethyl]-2-nitro-4-(trifluoromethanesulfonyl)aniline
N-[2-(4-tert-butylphenoxy)ethyl]-2-nitro-4-(trifluoromethanesulfonyl)aniline
Compound characteristics
| Compound ID: | 8014-6927 |
| Compound Name: | N-[2-(4-tert-butylphenoxy)ethyl]-2-nitro-4-(trifluoromethanesulfonyl)aniline |
| Molecular Weight: | 446.44 |
| Molecular Formula: | C19 H21 F3 N2 O5 S |
| Smiles: | CC(C)(C)c1ccc(cc1)OCCNc1ccc(cc1[N+]([O-])=O)S(C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7209 |
| logD: | 6.7209 |
| logSw: | -5.779 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.887 |
| InChI Key: | NRBAJJZTMCKLRD-UHFFFAOYSA-N |