2-(4-Ethoxy-2-nitrophenyl)-5,6-dimethyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione
2-(4-ethoxy-2-nitrophenyl)-5,6-dimethyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione
Also Known As: Oprea1_523680|BAS 02282861|AB00103118-01|AG-690/96050138|SR-01000449611-1|2-(4-ethoxy-2-nitrophenyl)-5,6-dimethyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione|2-(4-Ethoxy-2-nitro-phenyl)-5,6-dimethyl-3a,4,7,7a-tetrahydro-isoindole-1,3-dione|2-{4-ethoxy-2-nitrophenyl}-5,6-dimethyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione|2-(4-ETHOXY-2-NITROPHENYL)-5,6-DIMETHYL-2,3,3A,4,7,7A-HEXAHYDRO-1H-ISOINDOLE-1,3-DIONE
| Molecular Formula | C18H20N2O5 |
|---|---|
| Molecular Weight | 344.1372 g/mol |
| LogP | 3.2293 |
| Topological Polar Surface Area | 89.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 344.1372 |
| Monoisotopic Mass | 344.1372 |
| Heavy Atoms | 25 |
| Complexity | 766.6562 |
Chemical Identifiers
| CAS Number | 335205-60-2 |
|---|---|
| SMILES | CCOC1=CC(=C(C=C1)N2C(=O)C3CC(=C(CC3C2=O)C)C)[N+](=O)[O-] |
Product Overview
2-(4-Ethoxy-2-nitrophenyl)-5,6-dimethyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione (CAS 335205-60-2), with molecular formula C18H20N2O5 and molecular weight 344.1372 g/mol. IUPAC: 2-(4-ethoxy-2-nitrophenyl)-5,6-dimethyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione.