
TCO-PEG8-TCO | 2353409-67-1
Catalog Number | R15-0007 |
Category | Trans Cyclooctene (TCO) |
Molecular Formula | C₃₆H₆₄N₂O₁₂ |
Molecular Weight | 716.90 |
Catalog Number | Size | Price | Quantity |
---|---|---|---|
R15-0007 | -- | $-- |
* Please be kindly noted products are not for therapeutic use. We do not sell to patients.
Product Introduction
TCO-PEG8-TCO is a polyethylene glycol (PEG)-based PROTAC linker. TCO-PEG8-TCO can be used in the synthesis of a series of PROTACs.
- Chemical Information
- Product Specification
Synonyms | Di(cyclooct-4-en-1-yl) (3,6,9,12,15,18,21,24-octaoxahexacosane-1,26-diyl)dicarbamate; (4Z)-cyclooct-4-en-1-yl N-[26-({[(4Z)-cyclooct-4-en-1-yloxy]carbonyl}amino)-3,6,9,12,15,18,21,24-octaoxahexacosan-1-yl]carbamate; Di((E)-cyclooct-4-en-1-yl) (3,6,9,12,15,18,21,24-octaoxahexacosane-1,26-diyl)dicarbamate |
Purity | 95% |
IUPAC Name | [(4Z)-cyclooct-4-en-1-yl] N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[[(4Z)-cyclooct-4-en-1-yl]oxycarbonylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]carbamate |
Canonical SMILES | C1CC=CCCC(C1)OC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)OC2CCCC=CCC2 |
InChI | InChI=1S/C36H64N2O12/c39-35(49-33-11-7-3-1-4-8-12-33)37-15-17-41-19-21-43-23-25-45-27-29-47-31-32-48-30-28-46-26-24-44-22-20-42-18-16-38-36(40)50-34-13-9-5-2-6-10-14-34/h1-3,5,33-34H,4,6-32H2,(H,37,39)(H,38,40)/b3-1-,5-2- |
InChI Key | SPZWBIMXUPJMBJ-LEWNYYKSSA-N |
Storage | Please store the product under the recommended conditions in the Certificate of Analysis. |
Computed Properties | |
---|---|
XLogP3 | 3.1 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 12 |
Rotatable Bond Count | 31 |
Exact Mass | 716.44592548 g/mol |
Monoisotopic Mass | 716.44592548 g/mol |
Topological Polar Surface Area | 151Ų |
Heavy Atom Count | 50 |
Formal Charge | 0 |
Complexity | 795 |
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 |
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