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TCO-PEG10-acid
| Catalog Number | R15-0031 |
| Category | Trans Cyclooctene (TCO) |
| Molecular Formula | C32H59NO14 |
| Molecular Weight | 681.8 |
* Please be kindly noted products are not for therapeutic use. We do not sell to patients.
Chemical Information
Product Specification
Computed Properties
| IUPAC Name | 3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[[(4E)-cyclooct-4-en-1-yl]oxycarbonylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid |
| Canonical SMILES | C1CC=CCCC(C1)OC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)O |
| InChI | InChI=1S/C32H59NO14/c34-31(35)8-10-37-12-14-39-16-18-41-20-22-43-24-26-45-28-29-46-27-25-44-23-21-42-19-17-40-15-13-38-11-9-33-32(36)47-30-6-4-2-1-3-5-7-30/h1-2,30H,3-29H2,(H,33,36)(H,34,35)/b2-1+ |
| InChIKey | CXNJCECHLNNBDW-OWOJBTEDSA-N |
| Storage | -20 °C |
| XLogP3 | 0.3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 14 |
| Rotatable Bond Count | 35 |
| Exact Mass | 681.39355556 g/mol |
| Monoisotopic Mass | 681.39355556 g/mol |
| Topological Polar Surface Area | 168Ų |
| Heavy Atom Count | 47 |
| Formal Charge | 0 |
| Complexity | 730 |
| 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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