1-(2-fluoro-5-methylphenyl)-5-(methoxymethyl)-1H-1,2,3-triazole-4-carboxylic acid
Chemical Structure Depiction of
1-(2-fluoro-5-methylphenyl)-5-(methoxymethyl)-1H-1,2,3-triazole-4-carboxylic acid
1-(2-fluoro-5-methylphenyl)-5-(methoxymethyl)-1H-1,2,3-triazole-4-carboxylic acid
Compound characteristics
| Compound ID: | T640-0436 |
| Compound Name: | 1-(2-fluoro-5-methylphenyl)-5-(methoxymethyl)-1H-1,2,3-triazole-4-carboxylic acid |
| Molecular Weight: | 265.24 |
| Molecular Formula: | C12 H12 F N3 O3 |
| Smiles: | Cc1ccc(c(c1)n1c(COC)c(C(O)=O)nn1)F |
| Stereo: | ACHIRAL |
| logP: | 1.0763 |
| logD: | -5.9979 |
| logSw: | -1.697 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.123 |
| InChI Key: | IOBQGQPYXXLJKQ-UHFFFAOYSA-N |