TCO-PEG3-TCO | CAS 2243569-22-2

Name: TCO-PEG3-TCO
Brand: BOC Sciences
Rating: 5 (1 reviews)

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Product Introduction

TCO-PEG3-TCO is a polyethylene glycol (PEG)-based PROTAC linker. TCO-PEG3-TCO can be used in the synthesis of a series of PROTACs.

Synonyms	(4Z)-cyclooct-4-en-1-yl N-[2-(2-{2-[2-({[(4Z)-cyclooct-4-en-1-yloxy]carbonyl}amino)ethoxy]ethoxy}ethoxy)ethyl]carbamate
Purity	95%
IUPAC Name	[(4Z)-cyclooct-4-en-1-yl] N-[2-[2-[2-[2-[[(4Z)-cyclooct-4-en-1-yl]oxycarbonylamino]ethoxy]ethoxy]ethoxy]ethyl]carbamate
Canonical SMILES	C1CC=CCCC(C1)OC(=O)NCCOCCOCCOCCNC(=O)OC2CCCC=CCC2
InChI	InChI=1S/C26H44N2O7/c29-25(34-23-11-7-3-1-4-8-12-23)27-15-17-31-19-21-33-22-20-32-18-16-28-26(30)35-24-13-9-5-2-6-10-14-24/h1-3,5,23-24H,4,6-22H2,(H,27,29)(H,28,30)/b3-1-,5-2-
InChIKey	MPSXYJJDPFGIHW-LEWNYYKSSA-N
Solubility	DMSO, DCM, DMF

Storage

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

XLogP3	3.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	16
Exact Mass	496.31485175 g/mol
Monoisotopic Mass	496.31485175 g/mol
Topological Polar Surface Area	104Å²
Heavy Atom Count	35
Formal Charge	0
Complexity	575
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