methyl 5-chloro-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
methyl 5-chloro-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylate
methyl 5-chloro-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 8020-0089 |
| Compound Name: | methyl 5-chloro-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 305.64 |
| Molecular Formula: | C11 H7 Cl F3 N3 O2 |
| Smiles: | COC(c1c(n(c2cccc(c2)C(F)(F)F)nn1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.745 |
| logD: | 2.745 |
| logSw: | -3.466 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.637 |
| InChI Key: | YPAJODBFINHPRB-UHFFFAOYSA-N |