2-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)-4-nitrobenzoic acid
Chemical Structure Depiction of
2-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)-4-nitrobenzoic acid
2-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)-4-nitrobenzoic acid
Compound characteristics
| Compound ID: | 3668-0001 |
| Compound Name: | 2-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)-4-nitrobenzoic acid |
| Molecular Weight: | 330.29 |
| Molecular Formula: | C16 H14 N2 O6 |
| Smiles: | C1CC2CC1C1C2C(N(C1=O)c1cc(ccc1C(O)=O)[N+]([O-])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.5956 |
| logD: | -3.945 |
| logSw: | -2.2663 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.213 |
| InChI Key: | FOILVJIBZXSNNX-UHFFFAOYSA-N |