4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-epoxyisoindol-2-yl)phenyl acetate
Chemical Structure Depiction of
4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-epoxyisoindol-2-yl)phenyl acetate
4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-epoxyisoindol-2-yl)phenyl acetate
Compound characteristics
| Compound ID: | 4676-0382 |
| Compound Name: | 4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-epoxyisoindol-2-yl)phenyl acetate |
| Molecular Weight: | 299.28 |
| Molecular Formula: | C16 H13 N O5 |
| Smiles: | CC(=O)Oc1ccc(cc1)N1C(C2C(C3C=CC2O3)C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.3608 |
| logD: | 0.3608 |
| logSw: | -1.3325 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.255 |
| InChI Key: | GZDBXDZKEVWWRH-UHFFFAOYSA-N |