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| IUPAC Name: | 1-(1-benzyltriazol-4-yl)-N,N-bis[(1-benzyltriazol-4-yl)methyl]methanamine |
| Description: | TBTA is a tertiary amine with three 1,2,3-triazole groups. It is one of the most widely used water-insoluble ligands for copper-catalyzed azide-alkyne cycloadditions (CuAAC). |
| Molecular Weight: | 530.64 |
| Molecular Formula: | C30H30N10 |
| Canonical SMILES: | C1=CC=C(C=C1)CN2C=C(N=N2)CN(CC3=CN(N=N3)CC4=CC=CC=C4)CC5=CN(N=N5)CC6=CC=CC=C6 |
| InChI: | InChI=1S/C30H30N10/c1-4-10-25(11-5-1)16-38-22-28(31-34-38)19-37(20-29-23-39(35-32-29)17-26-12-6-2-7-13-26)21-30-24-40(36-33-30)18-27-14-8-3-9-15-27/h1-15,22-24H,16-21H2 |
| InChI Key: | WKGZJBVXZWCZQC-UHFFFAOYSA-N |
| MDL: | MFCD09265124 |
| LogP: | 3.80840 |
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