4-chloro-1-{[4-(propan-2-yl)phenoxy]methyl}-1H-pyrazole-3-carboxylic acid
Chemical Structure Depiction of
4-chloro-1-{[4-(propan-2-yl)phenoxy]methyl}-1H-pyrazole-3-carboxylic acid
4-chloro-1-{[4-(propan-2-yl)phenoxy]methyl}-1H-pyrazole-3-carboxylic acid
Compound characteristics
| Compound ID: | Y504-8797 |
| Compound Name: | 4-chloro-1-{[4-(propan-2-yl)phenoxy]methyl}-1H-pyrazole-3-carboxylic acid |
| Molecular Weight: | 294.74 |
| Molecular Formula: | C14 H15 Cl N2 O3 |
| Smiles: | CC(C)c1ccc(cc1)OCn1cc(c(C(O)=O)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.2017 |
| logD: | -0.9074 |
| logSw: | -3.2745 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.673 |
| InChI Key: | QUIMYBIREQJYNS-UHFFFAOYSA-N |