methyl 2-methyl-5-[(3-nitrophenyl)methoxy]-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
methyl 2-methyl-5-[(3-nitrophenyl)methoxy]-1-benzofuran-3-carboxylate
methyl 2-methyl-5-[(3-nitrophenyl)methoxy]-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | 4554-4841 |
| Compound Name: | methyl 2-methyl-5-[(3-nitrophenyl)methoxy]-1-benzofuran-3-carboxylate |
| Molecular Weight: | 341.32 |
| Molecular Formula: | C18 H15 N O6 |
| Smiles: | Cc1c(C(=O)OC)c2cc(ccc2o1)OCc1cccc(c1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9952 |
| logD: | 3.9952 |
| logSw: | -4.4691 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.969 |
| InChI Key: | GKSWWENXWUCHKA-UHFFFAOYSA-N |