| CAS Number | 1345337-28-1 |
| Catalog Number | AG019E81 |
| Chemical Name | Tos-PEG9-t-butyl ester |
| IUPAC Name | tert-butyl 3-[2-[2-[2-[2-[2-[2-[2-[2-(4-methylphenyl)sulfonyloxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoate |
| InChI | InChI=1S/C30H52O13S/c1-27-5-7-28(8-6-27)44(32,33)42-26-25-41-24-23-40-22-21-39-20-19-38-18-17-37-16-15-36-14-13-35-12-11-34-10-9-29(31)43-30(2,3)4/h5-8H,9-26H2,1-4H3 |
| InChI Key | AEHJPVCQXNLJCY-UHFFFAOYSA-N |
| MDL Number | MFCD30458056 |
| Molecular Formula | C30H52O13S |
| Molecular Weight | 652.7911 |
| SMILES | O=S(C1=CC=C(C=C1)C)(OCCOCCOCCOCCOCCOCCOCCOCCOCCC(OC(C)(C)C)=O)=O |
| Synonyms | Tos-PEG9-t-butyl ester,
1345337-28-1,
BP-23294,
|
| Complexity | 775 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 652.313g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 44 |
| Hydrogen Bond Acceptor Count | 13 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 652.793g/mol |
| Monoisotopic Mass | 652.313g/mol |
| Rotatable Bond Count | 31 |
| Topological Polar Surface Area | 152A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
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Certificate of Analysis
Lot Number