2-(2-methyl-4-nitrophenyl)-6,7-dinitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Chemical Structure Depiction of
2-(2-methyl-4-nitrophenyl)-6,7-dinitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
2-(2-methyl-4-nitrophenyl)-6,7-dinitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Compound characteristics
| Compound ID: | 8004-3393 |
| Compound Name: | 2-(2-methyl-4-nitrophenyl)-6,7-dinitro-1H-benzo[de]isoquinoline-1,3(2H)-dione |
| Molecular Weight: | 422.31 |
| Molecular Formula: | C19 H10 N4 O8 |
| Smiles: | Cc1cc(ccc1N1C(c2ccc(c3c(ccc(C1=O)c23)[N+]([O-])=O)[N+]([O-])=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5891 |
| logD: | 3.5891 |
| logSw: | -4.0395 |
| Hydrogen bond acceptors count: | 16 |
| Polar surface area: | 127.484 |
| InChI Key: | HNEZKHXMXZGDLP-UHFFFAOYSA-N |