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Tetrazine-NHS ester
Catalog NumberCCR1616668553
CAS Number1616668-55-3
CategoryTetrazines
| Synonyms | Tetrazine-Ph-NHS ester |
| IUPAC Name | (2,5-Dioxopyrrolidin-1-yl) 2-[4-(1,2,4,5-tetrazin-3-yl)phenyl]acetate |
| Molecular Weight | 313.27 |
| Molecular Formula | C14H11N5O4 |
| SMILES | C1CC(=O)N(C1=O)OC(=O)CC2=CC=C(C=C2)C3=NN=CN=N3 |
| InChI | InChI=1S/C14H11N5O4/c20-11-5-6-12(21)19(11)23-13(22)7-9-1-3-10(4-2-9)14-17-15-8-16-18-14/h1-4,8H,5-7H2 |
| InChI Key | ORWDYVDDJMYIQA-UHFFFAOYSA-N |
| Purity | 95%+ |
| Appearance | Solid |
| Application | IEDDA Click Reaction |
| Storage | -20 °C, Protect from light |
| Complexity | 456 |
| Exact Mass | 313.08110385 |
| Monoisotopic Mass | 313.08110385 |
| Topological Polar Surface Area | 115Ų |
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