| CAS Number | 1807537-31-0 |
| Catalog Number | AG00AT9A |
| Chemical Name | tert-Butyl 1-phenyl-2,5,8,11,14,17-hexaoxanonadecan-19-oate |
| IUPAC Name | tert-butyl 2-[2-[2-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetate |
| InChI | InChI=1S/C23H38O8/c1-23(2,3)31-22(24)20-30-18-16-28-14-12-26-10-9-25-11-13-27-15-17-29-19-21-7-5-4-6-8-21/h4-8H,9-20H2,1-3H3 |
| InChI Key | HTCCPCCHDIEUTN-UHFFFAOYSA-N |
| MDL Number | MFCD28142466 |
| Molecular Formula | C23H38O8 |
| Molecular Weight | 442.5430 |
| SMILES | O=C(OC(C)(C)C)COCCOCCOCCOCCOCCOCc1ccccc1 |
| Synonyms | Benzyl-PEG6-CH2CO2tBu,
1807537-31-0,
tert-Butyl 1-phenyl-2,5,8,11,14,17-hexaoxanonadecan-19-oate,
BIPG1194,
SCHEMBL20534920,
ZINC219025992,
BP-22339,
|
| Complexity | 418 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 442.256668g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 31 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 442.5g/mol |
| Monoisotopic Mass | 442.256668g/mol |
| Rotatable Bond Count | 21 |
| Topological Polar Surface Area | 81.7Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number