octyl 4-[5-(4-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]benzoate
Chemical Structure Depiction of
octyl 4-[5-(4-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]benzoate
octyl 4-[5-(4-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]benzoate
Compound characteristics
| Compound ID: | 8002-7173 |
| Compound Name: | octyl 4-[5-(4-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]benzoate |
| Molecular Weight: | 516.55 |
| Molecular Formula: | C29 H28 N2 O7 |
| Smiles: | CCCCCCCCOC(c1ccc(cc1)N1C(c2ccc(cc2C1=O)Oc1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 8.0843 |
| logD: | 8.0843 |
| logSw: | -5.7567 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 90.057 |
| InChI Key: | UKSHIOFZRHKWLZ-UHFFFAOYSA-N |