1-ethyl-4-(methoxycarbonyl)-1H-pyrazole-5-carboxylic acid
Chemical Structure Depiction of
1-ethyl-4-(methoxycarbonyl)-1H-pyrazole-5-carboxylic acid
1-ethyl-4-(methoxycarbonyl)-1H-pyrazole-5-carboxylic acid
Compound characteristics
| Compound ID: | Y507-3959 |
| Compound Name: | 1-ethyl-4-(methoxycarbonyl)-1H-pyrazole-5-carboxylic acid |
| Molecular Weight: | 198.17 |
| Molecular Formula: | C8 H10 N2 O4 |
| Smiles: | CCn1c(C(O)=O)c(cn1)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 0.1198 |
| logD: | -4.3985 |
| logSw: | -0.8015 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.775 |
| InChI Key: | VKOUCBPVXRNJIC-UHFFFAOYSA-N |