4,7,10,13-Tetraoxahexadeca-1,15-diyne

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4,7,10,13-Tetraoxahexadeca-1,15-diyne

4,7,10,13-Tetraoxahexadeca-1,15-diyne | 126422-58-0

Catalog Number R01-0149
Category Alkynes
Molecular Formula C12H18O4
Molecular Weight 226.27
Catalog Number Size Price Quantity
R01-0149 -- $--

Product Introduction

4,7,10,13-Tetraoxahexadeca-1,15-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-PEG4; Alkyne-PEG4-Alkyne; Propargyl-PEG4-Propargyl; Bis-propargyl-PEG3; 4,7,10,13-Tetraoxa-1,15-hexadecadiyne; α,ω-bis(O-propargyl)triethylene glycol
Purity >95%
IUPAC Name 3-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]prop-1-yne
Canonical SMILES C#CCOCCOCCOCCOCC#C
InChI InChI=1S/C12H18O4/c1-3-5-13-7-9-15-11-12-16-10-8-14-6-4-2/h1-2H,5-12H2
InChI Key PHRQSGRBGBTBAD-UHFFFAOYSA-N
Solubility Soluble in DMSO
Density 1.0±0.1 g/cm3
Appearance Pale Yellow Oily Liquid
Boiling Point 292.2±30.0 °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 -0.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 11
Exact Mass 226.12050905 g/mol
Monoisotopic Mass 226.12050905 g/mol
Topological Polar Surface Area 36.9Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 206
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

Patents

Publication NumberTitlePriority Date
EP-4095128-A1 Tetrahydroquinoline (thq) coumpounds 2021-05-25
WO-2022248475-A1 Tetrahydroquinoline (thq) coumpounds 2021-05-25
US-2020024265-A1 Carbohydrate-binding small molecules with antiviral activity 2018-07-23
US-11091468-B2 Carbohydrate-binding small molecules with antiviral activity 2018-07-23
CA-3105506-A1 Dimeric immuno-modulatory compounds against cereblon-based mechanisms 2018-07-11
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