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Methyltetrazine-PEG4-acid
| Catalog Number | CCR1802907910 |
| CAS | 1802907-91-0 |
| Synonyms | 1-(4-(6-Methyl-1,2,4,5-tetrazin-3-yl)phenoxy)-3,6,9,12-tetraoxapentadecan-15-oic acid |
| IUPAC Name | 3-[2-[2-[2-[2-[4-(6-Methyl-1,2,4,5-tetrazin-3-yl)phenoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid |
| Molecular Weight | 436.5 |
| Molecular Formula | C20H28N4O7 |
| Canonical SMILES | CC1=NN=C(N=N1)C2=CC=C(C=C2)OCCOCCOCCOCCOCCC(=O)O |
| InChI | InChI=1S/C20H28N4O7/c1-16-21-23-20(24-22-16)17-2-4-18(5-3-17)31-15-14-30-13-12-29-11-10-28-9-8-27-7-6-19(25)26/h2-5H,6-15H2,1H3,(H,25,26) |
| InChI Key | LMFGOJBYDNENPR-UHFFFAOYSA-N |
| Boiling Point | 647.6±65.0 °C(Predicted) |
| Density | 1.236±0.06 g/cm3(Predicted) |
| Solubility | Soluble in water, DMSO, DMF, DCM |
| Application | IEDDA Click Reaction |
| Complexity | 459 |
| Exact Mass | 436.19579924 |
| Monoisotopic Mass | 436.19579924 |
| pKa | 4.28±0.10(Predicted) |
| Topological Polar Surface Area | 135Ų |
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