Tri(propargyl-PEG2-NHCO-ethyloxyethyl)amine

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Tri(propargyl-PEG2-NHCO-ethyloxyethyl)amine

Tri(propargyl-PEG2-NHCO-ethyloxyethyl)amine

Catalog Number R01-0080
Category Alkynes
Molecular Formula C36H60N4O12
Molecular Weight 740.9
Catalog Number Size Price Quantity
R01-0080 -- $--
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Product Introduction

Tri(propargyl-PEG2-NHCO-ethyloxyethyl)amine

Chemical Information
Purity 98%
IUPAC Name 3-[2-[bis[2-[3-oxo-3-[2-(2-prop-2-ynoxyethoxy)ethylamino]propoxy]ethyl]amino]ethoxy]-N-[2-(2-prop-2-ynoxyethoxy)ethyl]propanamide
Canonical SMILES C#CCOCCOCCNC(=O)CCOCCN(CCOCCC(=O)NCCOCCOCC#C)CCOCCC(=O)NCCOCCOCC#C
InChI InChI=1S/C36H60N4O12/c1-4-16-44-28-31-50-22-10-37-34(41)7-19-47-25-13-40(14-26-48-20-8-35(42)38-11-23-51-32-29-45-17-5-2)15-27-49-21-9-36(43)39-12-24-52-33-30-46-18-6-3/h1-3H,7-33H2,(H,37,41)(H,38,42)(H,39,43)
InChI Key VELHXSSIPPGMGN-UHFFFAOYSA-N
Solubility DMSO, DCM, DMF
  • Product Specification
Storage -20 °C

Computed Properties
XLogP3 -3
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 13
Rotatable Bond Count 39
Exact Mass 740.42077336 g/mol
Monoisotopic Mass 740.42077336 g/mol
Topological Polar Surface Area 174Ų
Heavy Atom Count 52
Formal Charge 0
Complexity 908
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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