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Propargyl-PEG3-phosphonic acid | CAS 1714139-62-4
| Catalog Number | R01-0131 |
| Category | Alkynes |
| Molecular Formula | C₉H₁₇O₆P |
| Molecular Weight | 252.20 |
* Please be kindly noted products are not for therapeutic use. We do not sell to patients.
Product Introduction
Propargyl-PEG3-phosphonic acid is a polyethylene glycol (PEG)-based PROTAC linker. Propargyl-PEG3-phosphonic acid can be used in the synthesis of a series of PROTACs.
Chemical Information
Product Specification
Computed Properties
| Synonyms | (2-(2-(2-(prop-2-yn-1-yloxy)ethoxy)ethoxy)ethyl)phosphonic acid; Propargyl-PEG3-phosphonicacid; 2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethylphosphonic acid |
| Purity | 98% |
| IUPAC Name | 2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethylphosphonic acid |
| Canonical SMILES | C#CCOCCOCCOCCP(=O)(O)O |
| InChI | InChI=1S/C9H17O6P/c1-2-3-13-4-5-14-6-7-15-8-9-16(10,11)12/h1H,3-9H2,(H2,10,11,12) |
| InChIKey | OUKZOEDGARPKKQ-UHFFFAOYSA-N |
| Solubility | DMSO, DCM |
| Storage | Please store the product under the recommended conditions in the Certificate of Analysis. |
| XLogP3 | -1.9 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 10 |
| Exact Mass | 252.07627526 g/mol |
| Monoisotopic Mass | 252.07627526 g/mol |
| Topological Polar Surface Area | 85.2Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 252 |
| 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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