2-[bis(5-methylfuran-2-yl)methyl]-4-bromo-6-nitrophenol
Chemical Structure Depiction of
2-[bis(5-methylfuran-2-yl)methyl]-4-bromo-6-nitrophenol
2-[bis(5-methylfuran-2-yl)methyl]-4-bromo-6-nitrophenol
Compound characteristics
| Compound ID: | 5008-0020 |
| Compound Name: | 2-[bis(5-methylfuran-2-yl)methyl]-4-bromo-6-nitrophenol |
| Molecular Weight: | 392.2 |
| Molecular Formula: | C17 H14 Br N O5 |
| Smiles: | Cc1ccc(C(c2cc(cc(c2O)[N+]([O-])=O)[Br])c2ccc(C)o2)o1 |
| Stereo: | ACHIRAL |
| logP: | 5.8055 |
| logD: | 5.5437 |
| logSw: | -5.4762 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.44 |
| InChI Key: | VRBVDQFFZKACNF-UHFFFAOYSA-N |