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Pyrene-PEG5-alcohol | CAS 1817735-44-6
| Catalog Number | F08-0001 |
| Category | Pyrene Dyes |
| Molecular Formula | C₂₇H₃₁NO₆ |
| Molecular Weight | 465.54 |
* Please be kindly noted products are not for therapeutic use. We do not sell to patients.
Product Introduction
Pyrene-PEG5-alcohol is a polyethylene glycol (PEG)-based PROTAC linker. Pyrene-PEG5-alcohol can be used in the synthesis of a series of PROTACs.
Chemical Information
Product Specification
Computed Properties
| Synonyms | Pyrene-PEG5-OH; N-(14-Hydroxy-3,6,9,12-tetraoxatetradecyl)pyrene-1-carboxamide |
| Purity | 98% |
| IUPAC Name | N-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]pyrene-1-carboxamide |
| Canonical SMILES | C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C(=O)NCCOCCOCCOCCOCCO |
| InChI | InChI=1S/C27H31NO6/c29-11-13-32-15-17-34-19-18-33-16-14-31-12-10-28-27(30)24-9-7-22-5-4-20-2-1-3-21-6-8-23(24)26(22)25(20)21/h1-9,29H,10-19H2,(H,28,30) |
| InChIKey | DESHAVYJGOEYTK-UHFFFAOYSA-N |
| Solubility | DMSO, DMF, DCM |
| Fluorescence Quantum Yield | 1.00 |
| Excitation | 343; 326; 313 |
| Emission | 377; 397 |
| Storage | Please store the product under the recommended conditions in the Certificate of Analysis. |
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 15 |
| Exact Mass | 465.21513771 g/mol |
| Monoisotopic Mass | 465.21513771 g/mol |
| Topological Polar Surface Area | 86.2Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 604 |
| 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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