1-nitro-4-(trifluoromethanesulfonyl)benzene
Chemical Structure Depiction of
1-nitro-4-(trifluoromethanesulfonyl)benzene
1-nitro-4-(trifluoromethanesulfonyl)benzene
Compound characteristics
| Compound ID: | 0195-0020 |
| Compound Name: | 1-nitro-4-(trifluoromethanesulfonyl)benzene |
| Molecular Weight: | 255.17 |
| Molecular Formula: | C7 H4 F3 N O4 S |
| Smiles: | c1cc(ccc1[N+]([O-])=O)S(C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8925 |
| logD: | 2.8925 |
| logSw: | -3.5063 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.392 |
| InChI Key: | XCDAHECADGUHPH-UHFFFAOYSA-N |