N-ethyl-3-nitro-4-(trifluoromethanesulfonyl)aniline
Chemical Structure Depiction of
N-ethyl-3-nitro-4-(trifluoromethanesulfonyl)aniline
N-ethyl-3-nitro-4-(trifluoromethanesulfonyl)aniline
Compound characteristics
| Compound ID: | 1499-0433 |
| Compound Name: | N-ethyl-3-nitro-4-(trifluoromethanesulfonyl)aniline |
| Molecular Weight: | 298.24 |
| Molecular Formula: | C9 H9 F3 N2 O4 S |
| Smiles: | CCNc1ccc(c(c1)[N+]([O-])=O)S(C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.725 |
| logD: | 2.725 |
| logSw: | -3.3855 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.223 |
| InChI Key: | COSSKWQWOQLWOH-UHFFFAOYSA-N |