4-(1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl 4-nitrobenzoate
Chemical Structure Depiction of
4-(1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl 4-nitrobenzoate
4-(1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl 4-nitrobenzoate
Compound characteristics
| Compound ID: | 3043-0015 |
| Compound Name: | 4-(1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl 4-nitrobenzoate |
| Molecular Weight: | 394.38 |
| Molecular Formula: | C21 H18 N2 O6 |
| Smiles: | C1CCC2C(C1)C(N(C2=O)c1ccc(cc1)OC(c1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.9896 |
| logD: | 2.9896 |
| logSw: | -3.4519 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.831 |
| InChI Key: | MZTCVDDYQVINPU-UHFFFAOYSA-N |