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N-(PEG1-OH)-N-Boc-PEG2-propargyl | CAS 2100306-85-0
| Catalog Number | R01-0104 |
| Category | Alkynes |
| Molecular Formula | C₁₆H₂₉NO₆ |
| Molecular Weight | 331.40 |
* Please be kindly noted products are not for therapeutic use. We do not sell to patients.
Product Introduction
N-(PEG1-OH)-N-Boc-PEG2-propargyl is a polyethylene glycol (PEG)-based PROTAC linker. N-(PEG1-OH)-N-Boc-PEG2-propargyl can be used in the synthesis of a series of PROTACs.
Chemical Information
Product Specification
Computed Properties
| Synonyms | tert-butyl (2-(2-hydroxyethoxy)ethyl)(2-(2-(prop-2-yn-1-yloxy)ethoxy)ethyl)carbamate; tert-butyl N-[2-(2-hydroxyethoxy)ethyl]-N-{2-[2-(prop-2-yn-1-yloxy)ethoxy]ethyl}carbamate |
| Purity | 98% |
| IUPAC Name | tert-butyl N-[2-(2-hydroxyethoxy)ethyl]-N-[2-(2-prop-2-ynoxyethoxy)ethyl]carbamate |
| Canonical SMILES | CC(C)(C)OC(=O)N(CCOCCO)CCOCCOCC#C |
| InChI | InChI=1S/C16H29NO6/c1-5-9-20-13-14-22-11-7-17(6-10-21-12-8-18)15(19)23-16(2,3)4/h1,18H,6-14H2,2-4H3 |
| InChIKey | YEBWOLWOJRIJNN-UHFFFAOYSA-N |
| Storage | Please store the product under the recommended conditions in the Certificate of Analysis. |
| XLogP3 | 0.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 14 |
| Exact Mass | 331.19948764 g/mol |
| Monoisotopic Mass | 331.19948764 g/mol |
| Topological Polar Surface Area | 77.5Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 357 |
| 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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