4,7,10,13,16,19,22,25,28-Nonaoxahentriaconta-1,30-diyne

What We Offer

4,7,10,13,16,19,22,25,28-Nonaoxahentriaconta-1,30-diyne

4,7,10,13,16,19,22,25,28-Nonaoxahentriaconta-1,30-diyne | 1092554-87-4

Catalog Number R01-0143
Category Alkynes
Molecular Formula C22H38O9
Molecular Weight 446.53
Catalog Number Size Price Quantity
R01-0143 -- $--

Product Introduction

4,7,10,13,16,19,22,25,28-Nonaoxahentriaconta-1,30-diyne is a homobifunctional PEG linker with two propargyl groups. The propargyl group forms triazole linkage with azide-bearing compounds or biomolecules via copper catalyzed Click Chemistry.

Chemical Information

Synonyms Bis-propargyl-PEG9; Bis-Propargyl-PEG8
Purity >95%
IUPAC Name 3-[2-[2-[2-[2-[2-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]prop-1-yne
Canonical SMILES C#CCOCCOCCOCCOCCOCCOCCOCCOCCOCC#C
InChI InChI=1S/C22H38O9/c1-3-5-23-7-9-25-11-13-27-15-17-29-19-21-31-22-20-30-18-16-28-14-12-26-10-8-24-6-4-2/h1-2H,5-22H2
InChI Key MBRUWMSMSQUEOD-UHFFFAOYSA-N
Solubility Soluble in DMSO
Density 1.072±0.1 g/cm3
Appearance Pale Yellow or Colorless Oily Liquid
Boiling Point 495.5±40.0 °C at 760 mmHg
  • Product Specification
Storage Store at 2-8°C for short term (days to weeks) or -20°C for long term (months to years)

Computed Properties

XLogP3 -0.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 26
Exact Mass 446.25158279 g/mol
Monoisotopic Mass 446.25158279 g/mol
Topological Polar Surface Area 83.1Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 401
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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