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bis-PEG4-endo-BCN
| Catalog Number | R16-0005 |
| Category | BCN Reagents |
| Molecular Formula | C32H48N2O8 |
| Molecular Weight | 588.7 |
* Please be kindly noted products are not for therapeutic use. We do not sell to patients.
Product Introduction
bis-PEG4-endo-BCN is a homobifunctional click chemistry linker, PEG increase its aqueous solubility. The BCN group enable copper free click chemitry with azide-tagged molecules.
Chemical Information
Product Specification
Computed Properties
| Purity | 95% |
| IUPAC Name | [(1R,8S)-9-bicyclo[6.1.0]non-4-ynyl]methyl N-[2-[2-[2-[2-[2-[[(1R,8S)-9-bicyclo[6.1.0]non-4-ynyl]methoxycarbonylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]carbamate |
| Canonical SMILES | C1CC2C(C2COC(=O)NCCOCCOCCOCCOCCNC(=O)OCC3C4C3CCC#CCC4)CCC#C1 |
| InChI | InChI=1S/C32H48N2O8/c35-31(41-23-29-25-9-5-1-2-6-10-26(25)29)33-13-15-37-17-19-39-21-22-40-20-18-38-16-14-34-32(36)42-24-30-27-11-7-3-4-8-12-28(27)30/h25-30H,5-24H2,(H,33,35)(H,34,36)/t25-,26+,27-,28+,29?,30? |
| InChIKey | LPGIRCUGQRDRKM-QHNOGPKKSA-N |
| Solubility | DMSO, DCM, DMF |
| Storage | -20 °C |
| XLogP3 | 3.8 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 21 |
| Exact Mass | 588.34106649 g/mol |
| Monoisotopic Mass | 588.34106649 g/mol |
| Topological Polar Surface Area | 114Ų |
| Heavy Atom Count | 42 |
| Formal Charge | 0 |
| Complexity | 864 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 4 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
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