
4,7,10,13-Tetraoxahexadeca-1,15-diyne | CAS 126422-58-0
| Catalog Number | R01-0149 |
| Category | Alkynes |
| Molecular Formula | C12H18O4 |
| Molecular Weight | 226.27 |
* Please be kindly noted products are not for therapeutic use. We do not sell to patients.
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
Product Specification
Computed Properties
Patents
| 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 |
| InChIKey | 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 |
| Storage | Store at 2-8°C for short term (days to weeks) or -20°C for long term (months to years) |
| 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 |
| Publication Number | Title | Priority 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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