4,5,6,7-tetrachloro-2-(2-methoxy-4-nitrophenyl)-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
4,5,6,7-tetrachloro-2-(2-methoxy-4-nitrophenyl)-1H-isoindole-1,3(2H)-dione
4,5,6,7-tetrachloro-2-(2-methoxy-4-nitrophenyl)-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | K040-0047 |
| Compound Name: | 4,5,6,7-tetrachloro-2-(2-methoxy-4-nitrophenyl)-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 436.03 |
| Molecular Formula: | C15 H6 Cl4 N2 O5 |
| Smiles: | COc1cc(ccc1N1C(c2c(C1=O)c(c(c(c2[Cl])[Cl])[Cl])[Cl])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.227 |
| logD: | 4.227 |
| logSw: | -5.6386 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.591 |
| InChI Key: | JIIWVCSXZWRKBV-UHFFFAOYSA-N |