(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetic acid
Chemical Structure Depiction of
(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetic acid
(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetic acid
Compound characteristics
| Compound ID: | K061-1138 |
| Compound Name: | (4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetic acid |
| Molecular Weight: | 219.58 |
| Molecular Formula: | C6 H6 Cl N3 O4 |
| Smiles: | Cc1c(c(nn1CC(O)=O)[N+]([O-])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | -0.6722 |
| logD: | -4.7454 |
| logSw: | -1.7065 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.913 |
| InChI Key: | ARQFVRQZKJYVKU-UHFFFAOYSA-N |