propan-2-yl 2-methyl-5-[(3-nitrophenyl)methoxy]-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 2-methyl-5-[(3-nitrophenyl)methoxy]-1-benzofuran-3-carboxylate
propan-2-yl 2-methyl-5-[(3-nitrophenyl)methoxy]-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | 4554-4846 |
| Compound Name: | propan-2-yl 2-methyl-5-[(3-nitrophenyl)methoxy]-1-benzofuran-3-carboxylate |
| Molecular Weight: | 369.37 |
| Molecular Formula: | C20 H19 N O6 |
| Smiles: | CC(C)OC(c1c2cc(ccc2oc1C)OCc1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8877 |
| logD: | 4.8877 |
| logSw: | -5.0412 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.228 |
| InChI Key: | IZNPWQIBSWGYMU-UHFFFAOYSA-N |