6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid
Chemical Structure Depiction of
6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid
6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid
Compound characteristics
| Compound ID: | 1606-0065 |
| Compound Name: | 6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid |
| Molecular Weight: | 306.27 |
| Molecular Formula: | C14 H14 N2 O6 |
| Smiles: | C(CCC(O)=O)CCN1C(c2cccc(c2C1=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5223 |
| logD: | -2.3059 |
| logSw: | -2.2091 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.206 |
| InChI Key: | RDDDCNAVGLYHTA-UHFFFAOYSA-N |