Tri(propargyl-NHCO-ethyloxyethyl)amine

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Tri(propargyl-NHCO-ethyloxyethyl)amine

Tri(propargyl-NHCO-ethyloxyethyl)amine

Catalog Number R01-0081
Category Alkynes
Molecular Formula C24H36N4O6
Molecular Weight 476.6
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Product Introduction

Tri(propargyl-NHCO-ethyloxyethyl)amine is a trivalent compound featuring three propargyl groups, which are alkyne functionalities known for their participation in copper-catalyzed azide–alkyne cycloaddition reactions. This molecular architecture makes it suitable for applications in click chemistry, particularly in the design of multifunctional linkers and surface modification strategies. The compound's structural configuration facilitates its incorporation into complex macromolecular assemblies, enabling efficient bioconjugation and polymer functionalization processes.

  • Chemical Information

  • Product Specification

  • Application

  • Computed Properties

Chemical Information

Purity 98%
IUPAC Name 3-[2-[bis[2-[3-oxo-3-(prop-2-ynylamino)propoxy]ethyl]amino]ethoxy]-N-prop-2-ynylpropanamide
SMILES C#CCNC(=O)CCOCCN(CCOCCC(=O)NCC#C)CCOCCC(=O)NCC#C
InChI InChI=1S/C24H36N4O6/c1-4-10-25-22(29)7-16-32-19-13-28(14-20-33-17-8-23(30)26-11-5-2)15-21-34-18-9-24(31)27-12-6-3/h1-3H,7-21H2,(H,25,29)(H,26,30)(H,27,31)
InChIKey IREDTJVEYMNUME-UHFFFAOYSA-N
Solubility Water, DMSO, DCM, DMF

Product Specification

Storage -20 °C

Application

Computed Properties

XLogP3 -2.1
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 21
Exact Mass 476.26348488 g/mol
Monoisotopic Mass 476.26348488 g/mol
Topological Polar Surface Area 118Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 642
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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