methyl 5-amino-1-[2-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
methyl 5-amino-1-[2-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylate
methyl 5-amino-1-[2-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 8020-2807 |
| Compound Name: | methyl 5-amino-1-[2-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 286.21 |
| Molecular Formula: | C11 H9 F3 N4 O2 |
| Smiles: | COC(c1c(N)n(c2ccccc2C(F)(F)F)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.596 |
| logD: | 1.596 |
| logSw: | -2.0967 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.205 |
| InChI Key: | RYBHSFUNGYYBQQ-UHFFFAOYSA-N |