dimethyl 1-(4-chlorophenyl)-1H-1,2,3-triazole-4,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 1-(4-chlorophenyl)-1H-1,2,3-triazole-4,5-dicarboxylate
dimethyl 1-(4-chlorophenyl)-1H-1,2,3-triazole-4,5-dicarboxylate
Compound characteristics
| Compound ID: | C337-0263 |
| Compound Name: | dimethyl 1-(4-chlorophenyl)-1H-1,2,3-triazole-4,5-dicarboxylate |
| Molecular Weight: | 295.68 |
| Molecular Formula: | C12 H10 Cl N3 O4 |
| Smiles: | COC(c1c(C(=O)OC)n(c2ccc(cc2)[Cl])nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9678 |
| logD: | 1.9678 |
| logSw: | -2.5511 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.459 |
| InChI Key: | GMWRBFGYDOPWRV-UHFFFAOYSA-N |