bis(2-chloroethyl) {1-[4-(dimethylamino)phenyl]-2-nitroethyl}phosphonate
Chemical Structure Depiction of
bis(2-chloroethyl) {1-[4-(dimethylamino)phenyl]-2-nitroethyl}phosphonate
bis(2-chloroethyl) {1-[4-(dimethylamino)phenyl]-2-nitroethyl}phosphonate
Compound characteristics
| Compound ID: | 8005-5656 |
| Compound Name: | bis(2-chloroethyl) {1-[4-(dimethylamino)phenyl]-2-nitroethyl}phosphonate |
| Molecular Weight: | 399.21 |
| Molecular Formula: | C14 H21 Cl2 N2 O5 P |
| Smiles: | CN(C)c1ccc(cc1)C(C[N+]([O-])=O)P(=O)(OCC[Cl])OCC[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2729 |
| logD: | 2.2583 |
| logSw: | -2.6861 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.777 |
| InChI Key: | KQHNBNWEZOEGLP-AWEZNQCLSA-N |