4-iodo-1-(3,3,3-trifluoropropyl)-1H-pyrazole-5-carboxylic acid
Chemical Structure Depiction of
4-iodo-1-(3,3,3-trifluoropropyl)-1H-pyrazole-5-carboxylic acid
4-iodo-1-(3,3,3-trifluoropropyl)-1H-pyrazole-5-carboxylic acid
Compound characteristics
| Compound ID: | Y507-1413 |
| Compound Name: | 4-iodo-1-(3,3,3-trifluoropropyl)-1H-pyrazole-5-carboxylic acid |
| Molecular Weight: | 334.03 |
| Molecular Formula: | C7 H6 F3 I N2 O2 |
| Smiles: | C(Cn1c(C(O)=O)c(cn1)I)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 1.3568 |
| logD: | -2.7982 |
| logSw: | -1.2855 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.855 |
| InChI Key: | OEBQNRHTOBYFJQ-UHFFFAOYSA-N |