2-(3-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(3-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
2-(3-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 3970-0800 |
| Compound Name: | 2-(3-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione |
| Molecular Weight: | 286.24 |
| Molecular Formula: | C14 H10 N2 O5 |
| Smiles: | C1=CC2C3C(C1O2)C(N(C3=O)c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.7568 |
| logD: | 0.7568 |
| logSw: | -1.6803 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.886 |
| InChI Key: | LOSCZVODBPQGOD-UHFFFAOYSA-N |