2-(4-methyl-2-nitrophenyl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Chemical Structure Depiction of
2-(4-methyl-2-nitrophenyl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
2-(4-methyl-2-nitrophenyl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Compound characteristics
| Compound ID: | 3970-1082 |
| Compound Name: | 2-(4-methyl-2-nitrophenyl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione |
| Molecular Weight: | 324.33 |
| Molecular Formula: | C18 H16 N2 O4 |
| Smiles: | Cc1ccc(c(c1)[N+]([O-])=O)N1C(C2C3C=CC(C4CC34)C2C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.1164 |
| logD: | 2.1164 |
| logSw: | -2.6038 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.024 |
| InChI Key: | BXVIFRVMCZKCFS-UHFFFAOYSA-N |