TCO-PEG8-TFP ester

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TCO-PEG8-TFP ester

TCO-PEG8-TFP ester | 2353410-06-5

Catelog Number R15-0037
Category TCO
Molecular Formula C₃₄H₅₁F₄NO₁₂
Molecular Weight 741.76
Catalog Number Size Price Quantity
R15-0037 -- $--

Product Introduction

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

Chemical Information

Synonyms 2,3,5,6-Tetrafluorophenyl 1-(cyclooct-4-en-1-yloxy)-1-oxo-5,8,11,14,17,20,23,26-octaoxa-2-azanonacosan-29-oate; 2,3,5,6-Tetrafluorophenyl (E)-1-(cyclooct-4-en-1-yloxy)-1-oxo-5,8,11,14,17,20,23,26-octaoxa-2-azanonacosan-29-oate; 2,3,5,6-tetrafluorophenyl 1-({[(4Z)-cyclooct-4-en-1-yloxy]carbonyl}amino)-3,6,9,12,15,18,21,24-octaoxaheptacosan-27-oate
Purity 95%
IUPAC Name (2,3,5,6-tetrafluorophenyl) 3-[2-[2-[2-[2-[2-[2-[2-[2-[[(4Z)-cyclooct-4-en-1-yl]oxycarbonylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoate
Canonical SMILES C1CC=CCCC(C1)OC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)OC2=C(C(=CC(=C2F)F)F)F
InChI InChI=1S/C34H51F4NO12/c35-28-26-29(36)32(38)33(31(28)37)51-30(40)8-10-42-12-14-44-16-18-46-20-22-48-24-25-49-23-21-47-19-17-45-15-13-43-11-9-39-34(41)50-27-6-4-2-1-3-5-7-27/h1-2,26-27H,3-25H2,(H,39,41)/b2-1-
InChI Key LVMKBSBHWYSGNU-UPHRSURJSA-N

Product Specification

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

Computed Properties

XLogP3 2.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 16
Rotatable Bond Count 31
Exact Mass 741.33473871 g/mol
Monoisotopic Mass 741.33473871 g/mol
Topological Polar Surface Area 139Ų
Heavy Atom Count 51
Formal Charge 0
Complexity 897
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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