2-nitro-1-(phenylsulfanyl)-4-(trifluoromethyl)benzene
Chemical Structure Depiction of
2-nitro-1-(phenylsulfanyl)-4-(trifluoromethyl)benzene
2-nitro-1-(phenylsulfanyl)-4-(trifluoromethyl)benzene
Compound characteristics
| Compound ID: | 8011-4376 |
| Compound Name: | 2-nitro-1-(phenylsulfanyl)-4-(trifluoromethyl)benzene |
| Molecular Weight: | 299.27 |
| Molecular Formula: | C13 H8 F3 N O2 S |
| Smiles: | c1ccc(cc1)Sc1ccc(cc1[N+]([O-])=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 5.1001 |
| logD: | 5.1001 |
| logSw: | -5.5267 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.047 |
| InChI Key: | UBCNQWMQLBEUOC-UHFFFAOYSA-N |