1-(2-methylpropyl)-1H-pyrazole-5-carboxylic acid
Chemical Structure Depiction of
1-(2-methylpropyl)-1H-pyrazole-5-carboxylic acid
1-(2-methylpropyl)-1H-pyrazole-5-carboxylic acid
Compound characteristics
| Compound ID: | Y507-0401 |
| Compound Name: | 1-(2-methylpropyl)-1H-pyrazole-5-carboxylic acid |
| Molecular Weight: | 168.19 |
| Molecular Formula: | C8 H12 N2 O2 |
| Smiles: | CC(C)Cn1c(ccn1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9011 |
| logD: | -2.9408 |
| logSw: | -1.3203 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.011 |
| InChI Key: | XTWDDHNVKGTPLR-UHFFFAOYSA-N |