5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carbaldehyde
Chemical Structure Depiction of
5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carbaldehyde
5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carbaldehyde
Compound characteristics
| Compound ID: | Y509-3641 |
| Compound Name: | 5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carbaldehyde |
| Molecular Weight: | 249.22 |
| Molecular Formula: | C11 H11 N3 O4 |
| Smiles: | Cc1c(c(C)n(Cc2ccc(C=O)o2)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.0844 |
| logD: | 1.0844 |
| logSw: | -1.868 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.471 |
| InChI Key: | IJNGVKGADNONOL-UHFFFAOYSA-N |