endo-BCN-PEG3-mal

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endo-BCN-PEG3-mal

endo-BCN-PEG3-mal | 2141976-33-0

Catelog Number R16-0033
Category BCN
Molecular Formula C₂₆H₃₇N₃O₈
Molecular Weight 519.59
Catalog Number Size Price Quantity
R16-0033 -- $--
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Product Introduction

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

Chemical Information
Synonyms BCN-PEG3-Mal (endo)
Purity >90%
IUPAC Name [(1S,8R)-9-bicyclo[6.1.0]non-4-ynyl]methyl N-[2-[2-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]ethoxy]ethyl]carbamate
Canonical SMILES C1CC2C(C2COC(=O)NCCOCCOCCOCCNC(=O)CCN3C(=O)C=CC3=O)CCC#C1
InChI InChI=1S/C26H37N3O8/c30-23(9-12-29-24(31)7-8-25(29)32)27-10-13-34-15-17-36-18-16-35-14-11-28-26(33)37-19-22-20-5-3-1-2-4-6-21(20)22/h7-8,20-22H,3-6,9-19H2,(H,27,30)(H,28,33)/t20-,21+,22?
InChI Key ZZRUYTQNTVMKLG-CBQGHPETSA-N
Solubility DCM, THF, Acetonitrile, DMF and DMSO
Appearance Colorless liquid

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

Computed Properties
XLogP3 0.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 18
Exact Mass 519.25806515 g/mol
Monoisotopic Mass 519.25806515 g/mol
Topological Polar Surface Area 133Ų
Heavy Atom Count 37
Formal Charge 0
Complexity 857
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

Applications of Fluorescent Probes & Dyes

Laser Dye

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