4-(hydroxymethyl)-2-(2-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Chemical Structure Depiction of
4-(hydroxymethyl)-2-(2-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
4-(hydroxymethyl)-2-(2-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 8008-2568 |
| Compound Name: | 4-(hydroxymethyl)-2-(2-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione |
| Molecular Weight: | 316.27 |
| Molecular Formula: | C15 H12 N2 O6 |
| Smiles: | C(C12C=CC(C3C1C(N(C3=O)c1ccccc1[N+]([O-])=O)=O)O2)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.2463 |
| logD: | 0.2463 |
| logSw: | -1.4442 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.891 |
| InChI Key: | RAYRYKXJKVRUSN-UHFFFAOYSA-N |