| CAS Number | 882518-89-0 |
| Catalog Number | AG00IF0R(AGN-PC-0VK6WS) |
| Chemical Name | Acetic acid, [2-[2-[[(4-methylphenyl)sulfonyl]oxy]ethoxy]ethoxy]-,1,1-dimethylethyl ester |
| IUPAC Name | tert-butyl 2-[2-[2-(4-methylphenyl)sulfonyloxyethoxy]ethoxy]acetate |
| InChI | InChI=1S/C17H26O7S/c1-14-5-7-15(8-6-14)25(19,20)23-12-11-21-9-10-22-13-16(18)24-17(2,3)4/h5-8H,9-13H2,1-4H3 |
| InChI Key | NIPMXQFRYHXBAM-UHFFFAOYSA-N |
| MDL Number | MFCD27977515 |
| Molecular Formula | C17H26O7S |
| Molecular Weight | 374.4491 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCCOCCOCC(=O)OC(C)(C)C |
| Synonyms | Tos-PEG3-CH2CO2tBu,
882518-89-0,
BIPG1859,
SCHEMBL14129506,
ZINC96503344,
BP-22090,
A1-06425,
{2-[2-(Toluene-4-sulfonyloxy)-ethoxy]-ethoxy}-acetic acid tert-butyl ester,
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| Complexity | 482 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 374.14g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 374.448g/mol |
| Monoisotopic Mass | 374.14g/mol |
| Rotatable Bond Count | 12 |
| Topological Polar Surface Area | 96.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number