ethyl 4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoate
Chemical Structure Depiction of
ethyl 4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoate
ethyl 4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoate
Compound characteristics
| Compound ID: | 0918-1056 |
| Compound Name: | ethyl 4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoate |
| Molecular Weight: | 340.29 |
| Molecular Formula: | C17 H12 N2 O6 |
| Smiles: | CCOC(c1ccc(cc1)N1C(c2ccc(cc2C1=O)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2892 |
| logD: | 3.2892 |
| logSw: | -3.5728 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.015 |
| InChI Key: | BTXZNKLLUSGMDZ-UHFFFAOYSA-N |