dimethyl [(3,5-dichloro-2-methoxyphenyl)(4-nitroanilino)methyl]phosphonate
Chemical Structure Depiction of
dimethyl [(3,5-dichloro-2-methoxyphenyl)(4-nitroanilino)methyl]phosphonate
dimethyl [(3,5-dichloro-2-methoxyphenyl)(4-nitroanilino)methyl]phosphonate
Compound characteristics
| Compound ID: | 6732-0094 |
| Compound Name: | dimethyl [(3,5-dichloro-2-methoxyphenyl)(4-nitroanilino)methyl]phosphonate |
| Molecular Weight: | 435.2 |
| Molecular Formula: | C16 H17 Cl2 N2 O6 P |
| Smiles: | COc1c(cc(cc1[Cl])[Cl])C(Nc1ccc(cc1)[N+]([O-])=O)P(=O)(OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0872 |
| logD: | 4.0872 |
| logSw: | -4.4937 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.439 |
| InChI Key: | MFHATKXTEHHDGQ-INIZCTEOSA-N |