2-(2-methyl-5-nitrophenyl)-5-(4-nitrophenoxy)-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(2-methyl-5-nitrophenyl)-5-(4-nitrophenoxy)-1H-isoindole-1,3(2H)-dione
2-(2-methyl-5-nitrophenyl)-5-(4-nitrophenoxy)-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 8001-7203 |
| Compound Name: | 2-(2-methyl-5-nitrophenyl)-5-(4-nitrophenoxy)-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 419.35 |
| Molecular Formula: | C21 H13 N3 O7 |
| Smiles: | Cc1ccc(cc1N1C(c2ccc(cc2C1=O)Oc1ccc(cc1)[N+]([O-])=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.0277 |
| logD: | 5.0277 |
| logSw: | -4.7538 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 102.09 |
| InChI Key: | KYCJPAZRHFCYGS-UHFFFAOYSA-N |