1-(3-methoxyphenyl)-1H-1,2,3-triazole-4-carboxylic acid
Chemical Structure Depiction of
1-(3-methoxyphenyl)-1H-1,2,3-triazole-4-carboxylic acid
1-(3-methoxyphenyl)-1H-1,2,3-triazole-4-carboxylic acid
Compound characteristics
| Compound ID: | T640-0086 |
| Compound Name: | 1-(3-methoxyphenyl)-1H-1,2,3-triazole-4-carboxylic acid |
| Molecular Weight: | 219.2 |
| Molecular Formula: | C10 H9 N3 O3 |
| Smiles: | COc1cccc(c1)n1cc(C(O)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 1.0846 |
| logD: | -5.1056 |
| logSw: | -1.7617 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.556 |
| InChI Key: | HDECHAANEPCLLO-UHFFFAOYSA-N |