Pyrene-PEG5-alcohol

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Pyrene-PEG5-alcohol

Pyrene-PEG5-alcohol | 1817735-44-6

Catelog Number F08-0001
Category Pyrene
Molecular Formula C₂₇H₃₁NO₆
Molecular Weight 465.54
Catalog Number Size Price Quantity
F08-0001 -- $--

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

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)
InChI Key DESHAVYJGOEYTK-UHFFFAOYSA-N
Solubility DMSO, DMF, DCM

Product Specification

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.

Computed Properties

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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