5-(methoxymethyl)-1-[4-(propan-2-yl)phenyl]-1H-1,2,3-triazole-4-carboxylic acid
Chemical Structure Depiction of
5-(methoxymethyl)-1-[4-(propan-2-yl)phenyl]-1H-1,2,3-triazole-4-carboxylic acid
5-(methoxymethyl)-1-[4-(propan-2-yl)phenyl]-1H-1,2,3-triazole-4-carboxylic acid
Compound characteristics
| Compound ID: | T640-0073 |
| Compound Name: | 5-(methoxymethyl)-1-[4-(propan-2-yl)phenyl]-1H-1,2,3-triazole-4-carboxylic acid |
| Molecular Weight: | 275.3 |
| Molecular Formula: | C14 H17 N3 O3 |
| Smiles: | CC(C)c1ccc(cc1)n1c(COC)c(C(O)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 1.8809 |
| logD: | -5.1933 |
| logSw: | -2.2581 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.424 |
| InChI Key: | XRNKEUFYLIDJBX-UHFFFAOYSA-N |