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Chemical structure of Boc-C16-NHS ester

GC66206

Boc-C16-NHS ester

Also known as 1-O-tert-butyl 18-O-(2,5-dioxopyrrolidin-1-yl) octadecanedioate

Boc-C16-NHS ester is an alkyl/ether-based PROTAC linker that can be used in the synthesis of PROTACs

ChemicalCAS843666-34-2MW467.64FormulaC26H45NO6
CAS number
843666-34-2
Molecular weight
467.64
Formula
C26H45NO6
InChIKey
JTOVMMPSILRQQJ-UHFFFAOYSA-N
Catalogue number
GC66206
Brand
GLPBIO
Computed properties PubChem CID 58249213 · XLogP 7.2 · TPSA 90 Ų · H-bond donors 0
XLogP
7.2
TPSA
90 Ų
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
21
Heavy atoms
33

SMILES CC(C)(C)OC(=O)CCCCCCCCCCCCCCCCC(=O)ON1C(=O)CCC1=O

Computed descriptors from PubChem (CID 58249213), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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