dimethyl {(4-nitrophenyl)[3-(trifluoromethyl)anilino]methyl}phosphonate
Chemical Structure Depiction of
dimethyl {(4-nitrophenyl)[3-(trifluoromethyl)anilino]methyl}phosphonate
dimethyl {(4-nitrophenyl)[3-(trifluoromethyl)anilino]methyl}phosphonate
Compound characteristics
| Compound ID: | 2183-0080 |
| Compound Name: | dimethyl {(4-nitrophenyl)[3-(trifluoromethyl)anilino]methyl}phosphonate |
| Molecular Weight: | 404.28 |
| Molecular Formula: | C16 H16 F3 N2 O5 P |
| Smiles: | COP(C(c1ccc(cc1)[N+]([O-])=O)Nc1cccc(c1)C(F)(F)F)(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7559 |
| logD: | 3.7559 |
| logSw: | -4.0915 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.722 |
| InChI Key: | IPDGZWUHOJBAGH-HNNXBMFYSA-N |