{2-[4-(acetyloxy)phenyl]-1,3-dioxo-1,2,3,3a,7,7a-hexahydro-4H-4,7-epoxyisoindol-4-yl}methylene diacetate
Chemical Structure Depiction of
{2-[4-(acetyloxy)phenyl]-1,3-dioxo-1,2,3,3a,7,7a-hexahydro-4H-4,7-epoxyisoindol-4-yl}methylene diacetate
{2-[4-(acetyloxy)phenyl]-1,3-dioxo-1,2,3,3a,7,7a-hexahydro-4H-4,7-epoxyisoindol-4-yl}methylene diacetate
Compound characteristics
| Compound ID: | 4373-3494 |
| Compound Name: | {2-[4-(acetyloxy)phenyl]-1,3-dioxo-1,2,3,3a,7,7a-hexahydro-4H-4,7-epoxyisoindol-4-yl}methylene diacetate |
| Molecular Weight: | 429.38 |
| Molecular Formula: | C21 H19 N O9 |
| Smiles: | CC(=O)OC(C12C=CC(C3C1C(N(C3=O)c1ccc(cc1)OC(C)=O)=O)O2)OC(C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.2038 |
| logD: | 0.2038 |
| logSw: | -1.345 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 99.62 |
| InChI Key: | QNSWCCCHTNXZTQ-UHFFFAOYSA-N |