5-[2-(3-bromo-4-fluorophenyl)ethenyl]-3-methyl-4-nitro-1,2-oxazole
Chemical Structure Depiction of
5-[2-(3-bromo-4-fluorophenyl)ethenyl]-3-methyl-4-nitro-1,2-oxazole
5-[2-(3-bromo-4-fluorophenyl)ethenyl]-3-methyl-4-nitro-1,2-oxazole
Compound characteristics
| Compound ID: | 8018-1560 |
| Compound Name: | 5-[2-(3-bromo-4-fluorophenyl)ethenyl]-3-methyl-4-nitro-1,2-oxazole |
| Molecular Weight: | 327.11 |
| Molecular Formula: | C12 H8 Br F N2 O3 |
| Smiles: | Cc1c(c(/C=C/c2ccc(c(c2)[Br])F)on1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8377 |
| logD: | 3.8377 |
| logSw: | -4.2284 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.534 |
| InChI Key: | SRGGYWGAECSOBG-UHFFFAOYSA-N |