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Tetrazine-Ph-NHCO-C3-NHS ester
| Catalog | CCR1244040649 |
| CAS | 1244040-64-9 |
| Synonyms | 2,5-Dioxo-1-pyrrolidinyl 5-[4-(1,2,4,5-tetrazin-3-yl)benzylamino]-5-oxopentanoate |
| IUPAC Name | (2,5-Dioxopyrrolidin-1-yl) 5-oxo-5-[[4-(1,2,4,5-tetrazin-3-yl)phenyl]methylamino]pentanoate |
| Molecular Weight | 398.37 |
| Molecular Formula | C18H18N6O5 |
| Canonical SMILES | C1CC(=O)N(C1=O)OC(=O)CCCC(=O)NCC2=CC=C(C=C2)C3=NN=CN=N3 |
| InChI | InChI=1S/C18H18N6O5/c25-14(2-1-3-17(28)29-24-15(26)8-9-16(24)27)19-10-12-4-6-13(7-5-12)18-22-20-11-21-23-18/h4-7,11H,1-3,8-10H2,(H,19,25) |
| InChI Key | QDUUJWMNSUXICN-UHFFFAOYSA-N |
| Purity | 98%+ |
| Appearance | Solid |
| Application | IEDDA Click Reaction |
| Storage | 4 °C, Protect from light |
| Complexity | 600 |
| Exact Mass | 398.13386770 |
| Monoisotopic Mass | 398.13386770 |
| Topological Polar Surface Area | 144Ų |
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