TCO-PEG8-TCO

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TCO-PEG8-TCO

TCO-PEG8-TCO | 2353409-67-1

Catelog Number R15-0007
Category TCO
Molecular Formula C₃₆H₆₄N₂O₁₂
Molecular Weight 716.90
Catalog Number Size Price Quantity
R15-0007 -- $--

Product Introduction

TCO-PEG8-TCO is a polyethylene glycol (PEG)-based PROTAC linker. TCO-PEG8-TCO can be used in the synthesis of a series of PROTACs.

Chemical Information

Synonyms Di(cyclooct-4-en-1-yl) (3,6,9,12,15,18,21,24-octaoxahexacosane-1,26-diyl)dicarbamate; (4Z)-cyclooct-4-en-1-yl N-[26-({[(4Z)-cyclooct-4-en-1-yloxy]carbonyl}amino)-3,6,9,12,15,18,21,24-octaoxahexacosan-1-yl]carbamate; Di((E)-cyclooct-4-en-1-yl) (3,6,9,12,15,18,21,24-octaoxahexacosane-1,26-diyl)dicarbamate
Purity 95%
IUPAC Name [(4Z)-cyclooct-4-en-1-yl] N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[[(4Z)-cyclooct-4-en-1-yl]oxycarbonylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]carbamate
Canonical SMILES C1CC=CCCC(C1)OC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)OC2CCCC=CCC2
InChI InChI=1S/C36H64N2O12/c39-35(49-33-11-7-3-1-4-8-12-33)37-15-17-41-19-21-43-23-25-45-27-29-47-31-32-48-30-28-46-26-24-44-22-20-42-18-16-38-36(40)50-34-13-9-5-2-6-10-14-34/h1-3,5,33-34H,4,6-32H2,(H,37,39)(H,38,40)/b3-1-,5-2-
InChI Key SPZWBIMXUPJMBJ-LEWNYYKSSA-N

Product Specification

Storage Please store the product under the recommended conditions in the Certificate of Analysis.

Computed Properties

XLogP3 3.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 31
Exact Mass 716.44592548 g/mol
Monoisotopic Mass 716.44592548 g/mol
Topological Polar Surface Area 151Ų
Heavy Atom Count 50
Formal Charge 0
Complexity 795
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 2
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes
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