3-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde
Chemical Structure Depiction of
3-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde
3-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde
Compound characteristics
| Compound ID: | Y509-3636 |
| Compound Name: | 3-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde |
| Molecular Weight: | 295.68 |
| Molecular Formula: | C12 H10 Cl N3 O4 |
| Smiles: | COc1ccc(C=O)cc1Cn1cc(c(n1)[N+]([O-])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.9674 |
| logD: | 1.9674 |
| logSw: | -2.8205 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.624 |
| InChI Key: | FPUKYFGGQDBCGS-UHFFFAOYSA-N |