methyl 4-chloro-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
methyl 4-chloro-1H-pyrazole-3-carboxylate
methyl 4-chloro-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | Y503-2730 |
| Compound Name: | methyl 4-chloro-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 160.56 |
| Molecular Formula: | C5 H5 Cl N2 O2 |
| Smiles: | COC(c1c(c[nH]n1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 1.0383 |
| logD: | 1.0383 |
| logSw: | -2.2686 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.874 |
| InChI Key: | AQUQWWCPNUDMIX-UHFFFAOYSA-N |