1-(3,4-dimethylphenyl)-5-(methoxymethyl)-1H-1,2,3-triazole-4-carboxylic acid
Chemical Structure Depiction of
1-(3,4-dimethylphenyl)-5-(methoxymethyl)-1H-1,2,3-triazole-4-carboxylic acid
1-(3,4-dimethylphenyl)-5-(methoxymethyl)-1H-1,2,3-triazole-4-carboxylic acid
Compound characteristics
| Compound ID: | T640-0041 |
| Compound Name: | 1-(3,4-dimethylphenyl)-5-(methoxymethyl)-1H-1,2,3-triazole-4-carboxylic acid |
| Molecular Weight: | 261.28 |
| Molecular Formula: | C13 H15 N3 O3 |
| Smiles: | Cc1ccc(cc1C)n1c(COC)c(C(O)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 1.6702 |
| logD: | -5.404 |
| logSw: | -1.8009 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.424 |
| InChI Key: | JNJNKGCZXXVFIJ-UHFFFAOYSA-N |