5-(methoxymethyl)-1-[4-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylic acid
Chemical Structure Depiction of
5-(methoxymethyl)-1-[4-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylic acid
5-(methoxymethyl)-1-[4-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylic acid
Compound characteristics
| Compound ID: | T640-0338 |
| Compound Name: | 5-(methoxymethyl)-1-[4-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylic acid |
| Molecular Weight: | 301.22 |
| Molecular Formula: | C12 H10 F3 N3 O3 |
| Smiles: | COCc1c(C(O)=O)nnn1c1ccc(cc1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 1.4155 |
| logD: | -5.6587 |
| logSw: | -1.9041 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.424 |
| InChI Key: | XGHUDCPCADPUCA-UHFFFAOYSA-N |