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endo-BCN-PEG2-alcohol | 1807501-85-4
| Catelog Number | R16-0012 |
| Category | BCN |
| Molecular Formula | C₁₇H₂₇NO₅ |
| Molecular Weight | 325.40 |
| Catalog Number | Size | Price | Quantity |
|---|---|---|---|
| R16-0012 | -- | $-- |
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Product Introduction
endo-BCN-PEG2-alcohol is a polyethylene glycol (PEG)-based PROTAC linker. endo-BCN-PEG2-alcohol can be used in the synthesis of a series of PROTACs.
Chemical Information |
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|---|---|
| Synonyms | bicyclo[6.1.0]non-4-yn-9-ylmethyl (2-(2-(2-hydroxyethoxy)ethoxy)ethyl)carbamate; endo-BCN-PEG2-OH; endo-BCN-PEG2-Hydroxy; {bicyclo[6.1.0]non-4-yn-9-yl}methyl N-{2-[2-(2-hydroxyethoxy)ethoxy]ethyl}carbamate; 9-bicyclo[6.1.0]non-4-ynylmethyl N-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]carbamate |
| Purity | 95% |
| IUPAC Name | 9-bicyclo[6.1.0]non-4-ynylmethyl N-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]carbamate |
| Canonical SMILES | C1CC2C(C2COC(=O)NCCOCCOCCO)CCC#C1 |
| InChI | InChI=1S/C17H27NO5/c19-8-10-22-12-11-21-9-7-18-17(20)23-13-16-14-5-3-1-2-4-6-15(14)16/h14-16,19H,3-13H2,(H,18,20) |
| InChI Key | PEXDOIHAKXYTET-UHFFFAOYSA-N |
| Solubility | Water, DMSO, DCM, DMF |
Product Specification |
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| Storage | Please store the product under the recommended conditions in the Certificate of Analysis. |
Computed Properties | |
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| XLogP3 | 1.4 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 11 |
| Exact Mass | 325.18892296 g/mol |
| Monoisotopic Mass | 325.18892296 g/mol |
| Topological Polar Surface Area | 77Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 409 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
Applications of Fluorescent Probes & Dyes
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