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TCO-C3-PEG3-C3-amine | CAS 2028288-77-7
| Catalog Number | R15-0019 |
| Category | Trans Cyclooctene (TCO) |
| Molecular Formula | C₁₉H₃₆N₂O₅ |
| Molecular Weight | 372.50 |
* Please be kindly noted products are not for therapeutic use. We do not sell to patients.
Product Introduction
TCO-C3-PEG3-C3-amine is a polyethylene glycol (PEG)-based PROTAC linker. TCO-C3-PEG3-C3-amine can be used in the synthesis of a series of PROTACs.
Chemical Information
Product Specification
Computed Properties
| Synonyms | (E)-cyclooct-4-en-1-yl (3-(2-(2-(3-aminopropoxy)ethoxy)ethoxy)propyl)carbamate |
| Purity | 95% |
| IUPAC Name | [(4E)-cyclooct-4-en-1-yl] N-[3-[2-[2-(3-aminopropoxy)ethoxy]ethoxy]propyl]carbamate |
| Canonical SMILES | C1CC=CCCC(C1)OC(=O)NCCCOCCOCCOCCCN |
| InChI | InChI=1S/C19H36N2O5/c20-10-6-12-23-14-16-25-17-15-24-13-7-11-21-19(22)26-18-8-4-2-1-3-5-9-18/h1-2,18H,3-17,20H2,(H,21,22)/b2-1+ |
| InChIKey | ZWCIHUBGBBHCSO-OWOJBTEDSA-N |
| Storage | Please store the product under the recommended conditions in the Certificate of Analysis. |
| XLogP3 | 1.6 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 15 |
| Exact Mass | 372.26242225 g/mol |
| Monoisotopic Mass | 372.26242225 g/mol |
| Topological Polar Surface Area | 92Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 366 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
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