4-methylphenyl 2,2-difluoro-1-(2-fluorophenyl)-2-nitroethane-1-sulfonate
Chemical Structure Depiction of
4-methylphenyl 2,2-difluoro-1-(2-fluorophenyl)-2-nitroethane-1-sulfonate
4-methylphenyl 2,2-difluoro-1-(2-fluorophenyl)-2-nitroethane-1-sulfonate
Compound characteristics
| Compound ID: | 8006-8250 |
| Compound Name: | 4-methylphenyl 2,2-difluoro-1-(2-fluorophenyl)-2-nitroethane-1-sulfonate |
| Molecular Weight: | 375.32 |
| Molecular Formula: | C15 H12 F3 N O5 S |
| Smiles: | Cc1ccc(cc1)OS(C(c1ccccc1F)C([N+]([O-])=O)(F)F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2299 |
| logD: | 4.2299 |
| logSw: | -4.2766 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.615 |
| InChI Key: | MERGSBANKBIQNR-CQSZACIVSA-N |