(3-methyl-4-nitro-1H-pyrazol-1-yl)acetic acid
Chemical Structure Depiction of
(3-methyl-4-nitro-1H-pyrazol-1-yl)acetic acid
(3-methyl-4-nitro-1H-pyrazol-1-yl)acetic acid
Compound characteristics
| Compound ID: | Y042-3167 |
| Compound Name: | (3-methyl-4-nitro-1H-pyrazol-1-yl)acetic acid |
| Molecular Weight: | 185.14 |
| Molecular Formula: | C6 H7 N3 O4 |
| Smiles: | Cc1c(cn(CC(O)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -1.165 |
| logD: | -4.8912 |
| logSw: | -0.618 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.833 |
| InChI Key: | XIXBNMMGKJHUJH-UHFFFAOYSA-N |