dimethyl 1-phenyl-1H-1,2,3-triazole-4,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 1-phenyl-1H-1,2,3-triazole-4,5-dicarboxylate
dimethyl 1-phenyl-1H-1,2,3-triazole-4,5-dicarboxylate
Compound characteristics
| Compound ID: | C337-0254 |
| Compound Name: | dimethyl 1-phenyl-1H-1,2,3-triazole-4,5-dicarboxylate |
| Molecular Weight: | 261.23 |
| Molecular Formula: | C12 H11 N3 O4 |
| Smiles: | COC(c1c(C(=O)OC)n(c2ccccc2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2515 |
| logD: | 1.2515 |
| logSw: | -1.6571 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.459 |
| InChI Key: | KCKQEVLPVNRLNX-UHFFFAOYSA-N |