3-(2-methylpropyl)-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
3-(2-methylpropyl)-1H-pyrazole-4-carboxylic acid
3-(2-methylpropyl)-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | 8018-8680 |
| Compound Name: | 3-(2-methylpropyl)-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 168.19 |
| Molecular Formula: | C8 H12 N2 O2 |
| Smiles: | CC(C)Cc1c(c[nH]n1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8205 |
| logD: | -1.7053 |
| logSw: | -2.1119 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.603 |
| InChI Key: | JILAPOUDFIPUBR-UHFFFAOYSA-N |