methyl 2-(3-nitrophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
Chemical Structure Depiction of
methyl 2-(3-nitrophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
methyl 2-(3-nitrophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
Compound characteristics
| Compound ID: | 0983-0071 |
| Compound Name: | methyl 2-(3-nitrophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate |
| Molecular Weight: | 326.26 |
| Molecular Formula: | C16 H10 N2 O6 |
| Smiles: | COC(c1ccc2C(N(C(c2c1)=O)c1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8317 |
| logD: | 2.8317 |
| logSw: | -3.3857 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.435 |
| InChI Key: | VDOJBJNUQWTLHR-UHFFFAOYSA-N |