methyl 1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
Chemical Structure Depiction of
methyl 1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
methyl 1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
Compound characteristics
| Compound ID: | 0584-0078 |
| Compound Name: | methyl 1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate |
| Molecular Weight: | 205.17 |
| Molecular Formula: | C10 H7 N O4 |
| Smiles: | COC(c1ccc2C(NC(c2c1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0511 |
| logD: | 0.847 |
| logSw: | -2.3316 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.178 |
| InChI Key: | JRFHQEZVUKIDMX-UHFFFAOYSA-N |