3-[2-chloro-5-(trifluoromethyl)anilino]-3,4-dihydro-2H-1,5,3lambda~5~-benzodioxaphosphepin-3-one
Chemical Structure Depiction of
3-[2-chloro-5-(trifluoromethyl)anilino]-3,4-dihydro-2H-1,5,3lambda~5~-benzodioxaphosphepin-3-one
3-[2-chloro-5-(trifluoromethyl)anilino]-3,4-dihydro-2H-1,5,3lambda~5~-benzodioxaphosphepin-3-one
Compound characteristics
| Compound ID: | 8017-7621 |
| Compound Name: | 3-[2-chloro-5-(trifluoromethyl)anilino]-3,4-dihydro-2H-1,5,3lambda~5~-benzodioxaphosphepin-3-one |
| Molecular Weight: | 377.68 |
| Molecular Formula: | C15 H12 Cl F3 N O3 P |
| Smiles: | C1Oc2ccccc2OCP1(Nc1cc(ccc1[Cl])C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9887 |
| logD: | 3.9887 |
| logSw: | -4.4186 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.711 |
| InChI Key: | XRDAOWZCKADTJT-UHFFFAOYSA-N |