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Chemical structure of 3,4-Dibromo-Mal-PEG8-Boc

GC66518

3,4-Dibromo-Mal-PEG8-Boc

Also known as tert-butyl 3-[2-[2-[2-[2-[2-[2-[2-[2-(3,4-dibromo-2,5-dioxopyrrol-1-yl)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoate

3,4-Dibromo-Mal-PEG8-Boc is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs

ChemicalCAS2055198-02-0MW735.45FormulaC27H45Br2NO12
CAS number
2055198-02-0
Molecular weight
735.45
Formula
C27H45Br2NO12
InChIKey
NRCHSTUDEZBNCB-UHFFFAOYSA-N
Catalogue number
GC66518
Brand
GLPBIO
Computed properties PubChem CID 126480500 · XLogP 0.9 · TPSA 138 Ų · H-bond donors 0
XLogP
0.9
TPSA
138 Ų
H-bond donors
0
H-bond acceptors
12
Rotatable bonds
29
Heavy atoms
42

SMILES CC(C)(C)OC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCN1C(=O)C(=C(C1=O)Br)Br

Computed descriptors from PubChem (CID 126480500), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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