2-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoic acid
Chemical Structure Depiction of
2-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoic acid
2-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoic acid
Compound characteristics
| Compound ID: | 2036-0020 |
| Compound Name: | 2-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoic acid |
| Molecular Weight: | 312.24 |
| Molecular Formula: | C15 H8 N2 O6 |
| Smiles: | c1ccc(c(c1)C(O)=O)N1C(c2ccc(cc2C1=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.62 |
| logD: | -3.2935 |
| logSw: | -2.9868 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.369 |
| InChI Key: | NQKOVLDHWLEHES-UHFFFAOYSA-N |