propan-2-yl 2-methyl-5-[(3-nitrobenzoyl)oxy]-1-benzofuran-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 2-methyl-5-[(3-nitrobenzoyl)oxy]-1-benzofuran-3-carboxylate
propan-2-yl 2-methyl-5-[(3-nitrobenzoyl)oxy]-1-benzofuran-3-carboxylate
Compound characteristics
| Compound ID: | 3570-0533 |
| Compound Name: | propan-2-yl 2-methyl-5-[(3-nitrobenzoyl)oxy]-1-benzofuran-3-carboxylate |
| Molecular Weight: | 383.36 |
| Molecular Formula: | C20 H17 N O7 |
| Smiles: | CC(C)OC(c1c2cc(ccc2oc1C)OC(c1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4004 |
| logD: | 4.4004 |
| logSw: | -4.632 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.378 |
| InChI Key: | SDDIUWSJAFDUNL-UHFFFAOYSA-N |