1H-Isoindole-1,3(2H)-dione, 2-[1-(3-ethoxy-4-Methoxyphenyl)-2-(Methylsulfonyl)ethyl]-
- Product Name1H-Isoindole-1,3(2H)-dione, 2-[1-(3-ethoxy-4-Methoxyphenyl)-2-(Methylsulfonyl)ethyl]-
- CAS253168-83-1
- MFC20H22N2O6S
- MW418.46
- EINECS
- MOL File253168-83-1.mol
Chemical Properties
| Boiling point | 673.6±55.0 °C(Predicted) |
| Density | 1.383±0.06 g/cm3(Predicted) |
| pka | -0.76±0.20(Predicted) |
| InChI | InChI=1S/C20H22N2O6S/c1-4-28-17-10-12(8-9-16(17)27-2)15(11-29(3,25)26)22-19(23)13-6-5-7-14(21)18(13)20(22)24/h5-10,15H,4,11,21H2,1-3H3 |
| InChIKey | BHJUWEUNUCJYER-UHFFFAOYSA-N |
| SMILES | C1(=O)C2=C(C(N)=CC=C2)C(=O)N1C(C1=CC=C(OC)C(OCC)=C1)CS(C)(=O)=O |