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N-bis(PEG2-propargyl)-N-(PEG2-amidoPEG1)-N-(bis(PEG2-propargyl)
| Catalog Number | R01-0073 |
| Category | Alkynes |
| Molecular Formula | C39H65N3O12 |
| Molecular Weight | 768.0 |
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Product Introduction
N-bis(PEG2-propargyl)-N-(PEG2-amidoPEG1)-N-(bis(PEG2-propargyl)) features a multi-arm architecture, incorporating propargyl groups that facilitate copper-catalyzed azide–alkyne cycloaddition. This reagent's structure supports its integration into complex bioconjugation and labeling strategies, allowing for precise attachment to azide-functionalized biomolecules. Its design is particularly suited for applications in surface modification and polymer functionalization, where the PEG linkers provide enhanced solubility and reduced steric hindrance, enabling efficient coupling reactions.
Chemical Information
Product Specification
Application
Computed Properties
Chemical Information
| Purity | 98% |
| IUPAC Name | 3-[2-[2-[bis[2-(2-prop-2-ynoxyethoxy)ethyl]amino]ethoxy]ethoxy]-N-[2-[2-[bis[2-(2-prop-2-ynoxyethoxy)ethyl]amino]ethoxy]ethyl]propanamide |
| SMILES | C#CCOCCOCCN(CCOCCNC(=O)CCOCCOCCN(CCOCCOCC#C)CCOCCOCC#C)CCOCCOCC#C |
| InChI | InChI=1S/C39H65N3O12/c1-5-17-44-29-34-50-24-12-41(13-25-51-35-30-45-18-6-2)11-23-49-22-10-40-39(43)9-21-48-33-38-54-28-16-42(14-26-52-36-31-46-19-7-3)15-27-53-37-32-47-20-8-4/h1-4H,9-38H2,(H,40,43) |
| InChIKey | TXWZFGHNRJJSJO-UHFFFAOYSA-N |
Product Specification
| Storage | -20 °C |
Application
N-bis(PEG2-propargyl)-N-(PEG2-amidoPEG1)-N-(bis(PEG2-propargyl) is a multi-functional, PEG-based propargylated click chemistry reagent designed for copper-free and/or copper-catalyzed azide–alkyne cycloaddition workflows. Its architecture combines multiple terminal alkyne handles with PEG spacers and an amide-containing linkage, enabling efficient conjugation to azide-functional biomolecules, polymers, and surfaces while supporting aqueous compatibility and reduced non-specific interactions. Such PEG-rich, multi-alkyne reagents are widely used in chemical biology and biomaterials research to build modular, multivalent labeling reagents, functionalize carriers, and generate imaging or assay platforms that benefit from controlled handle density.
1. Multivalent Biomolecule Labeling
N-bis(PEG2-propargyl)-N-(PEG2-amidoPEG1)-N-(bis(PEG2-propargyl) is used to introduce multiple alkyne groups onto azide-bearing targets, supporting multivalent conjugation strategies that improve labeling robustness in complex biological assay workflows. Researchers commonly pair this reagent with azide-functional proteins, peptides, or nucleic-acid constructs to create higher-density attachment patterns for downstream probe assembly, including fluorescent or affinity-tagged derivatives. The PEG spacers help maintain solubility and accessibility of reactive groups, which is particularly valuable when conjugates must remain stable during incubation steps and subsequent purification.
2. Surface And Material Functionalization
N-bis(PEG2-propargyl)-N-(PEG2-amidoPEG1)-N-(bis(PEG2-propargyl) is well suited for functionalizing azide-activated surfaces and polymeric materials used in biomaterials science and diagnostics reagent development. The presence of several propargyl termini enables dense grafting onto azide-functional coatings, hydrogels, or membrane-like supports, allowing researchers to tune the effective presentation of reactive handles for later coupling steps. This reagent is frequently selected when a PEG-rich interface is desired to reduce fouling and to promote uniform attachment of capture ligands, affinity reagents, or modular reporter components.
3. Modular Probe And Linker Synthesis
N-bis(PEG2-propargyl)-N-(PEG2-amidoPEG1)-N-(bis(PEG2-propargyl) serves as a versatile PEG-based alkyne building block for assembling modular chemical probes and linkers in molecular imaging and chemical biology tool development. Its multi-alkyne functionality supports stepwise construction of conjugates where azide-bearing fluorophores, affinity tags, or reporter moieties are introduced in a controlled, combinatorial manner. By providing flexible PEG spacing between conjugation points, the reagent helps preserve probe solubility and reduces steric constraints that can otherwise limit labeling efficiency for larger imaging or assay components.
4. Polymer Conjugates And Crosslinking Platforms
N-bis(PEG2-propargyl)-N-(PEG2-amidoPEG1)-N-(bis(PEG2-propargyl) is used in the preparation of PEG-rich polymer conjugates and network-forming materials where azide–alkyne coupling is employed to install functional groups or to generate controlled crosslinking architectures. In research settings, the reagent is incorporated into polymer modification workflows to create functional copolymers, multivalent scaffolds, or tunable hydrogel components that can later be decorated with bio-recognition elements. The PEG backbone and multiple alkyne handles support aqueous processing and enable reproducible downstream functionalization, which is advantageous for building libraries of conjugates used in assay development and materials characterization.
Computed Properties
| XLogP3 | -1.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 14 |
| Rotatable Bond Count | 43 |
| Exact Mass | 767.45682452 g/mol |
| Monoisotopic Mass | 767.45682452 g/mol |
| Topological Polar Surface Area | 137Ų |
| Heavy Atom Count | 54 |
| Formal Charge | 0 |
| Complexity | 985 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
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