1-(4-fluoro-3-methylphenyl)-5-(methoxymethyl)-1H-1,2,3-triazole-4-carboxylic acid
Chemical Structure Depiction of
1-(4-fluoro-3-methylphenyl)-5-(methoxymethyl)-1H-1,2,3-triazole-4-carboxylic acid
1-(4-fluoro-3-methylphenyl)-5-(methoxymethyl)-1H-1,2,3-triazole-4-carboxylic acid
Compound characteristics
| Compound ID: | T640-0374 |
| Compound Name: | 1-(4-fluoro-3-methylphenyl)-5-(methoxymethyl)-1H-1,2,3-triazole-4-carboxylic acid |
| Molecular Weight: | 265.24 |
| Molecular Formula: | C12 H12 F N3 O3 |
| Smiles: | Cc1cc(ccc1F)n1c(COC)c(C(O)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 1.1407 |
| logD: | -5.9335 |
| logSw: | -1.837 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.424 |
| InChI Key: | XKMMIPPSTWTWRN-UHFFFAOYSA-N |