TCO-PEG8-acid

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TCO-PEG8-acid

TCO-PEG8-acid | 2353410-03-2

Catelog Number R15-0033
Category TCO
Molecular Formula C₂₈H₅₁NO₁₂
Molecular Weight 593.70
Catalog Number Size Price Quantity
R15-0033 -- $--

Product Introduction

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

Chemical Information

Synonyms 1-(Cyclooct-4-en-1-yloxy)-1-oxo-5,8,11,14,17,20,23,26-octaoxa-2-azanonacosan-29-oic acid; 1-({[(4Z)-cyclooct-4-en-1-yloxy]carbonyl}amino)-3,6,9,12,15,18,21,24-octaoxaheptacosan-27-oic acid
Purity 95%
IUPAC Name 3-[2-[2-[2-[2-[2-[2-[2-[2-[[(4Z)-cyclooct-4-en-1-yl]oxycarbonylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
Canonical SMILES C1CC=CCCC(C1)OC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)O
InChI InChI=1S/C28H51NO12/c30-27(31)8-10-33-12-14-35-16-18-37-20-22-39-24-25-40-23-21-38-19-17-36-15-13-34-11-9-29-28(32)41-26-6-4-2-1-3-5-7-26/h1-2,26H,3-25H2,(H,29,32)(H,30,31)/b2-1-
InChI Key LIPCJNZAKQKTRV-UPHRSURJSA-N
Solubility Water, DMSO, DCM, DMF

Product Specification

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

Computed Properties

XLogP3 0.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 29
Exact Mass 593.34112606 g/mol
Monoisotopic Mass 593.34112606 g/mol
Topological Polar Surface Area 150Ų
Heavy Atom Count 41
Formal Charge 0
Complexity 637
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes
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