3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoic acid
Chemical Structure Depiction of
3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoic acid
3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoic acid
Compound characteristics
| Compound ID: | 0139-0233 |
| Compound Name: | 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoic acid |
| Molecular Weight: | 219.19 |
| Molecular Formula: | C11 H9 N O4 |
| Smiles: | C(CN1C(c2ccccc2C1=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.0737 |
| logD: | -2.4589 |
| logSw: | -2.0636 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.125 |
| InChI Key: | DXXHRZUOTPMGEH-UHFFFAOYSA-N |