2-(2-hydroxyethyl)-4-nitro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(2-hydroxyethyl)-4-nitro-1H-isoindole-1,3(2H)-dione
2-(2-hydroxyethyl)-4-nitro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 0812-1003 |
| Compound Name: | 2-(2-hydroxyethyl)-4-nitro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 236.18 |
| Molecular Formula: | C10 H8 N2 O5 |
| Smiles: | C(CO)N1C(c2cccc(c2C1=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.4752 |
| logD: | -0.4752 |
| logSw: | -2.3279 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.477 |
| InChI Key: | YWARSQALHOUZGW-UHFFFAOYSA-N |