| CAS Number | 1196732-52-1 |
| Catalog Number | AG000PF6(AGN-PC-0WR1RM) |
| Chemical Name | 3,6,9,12,15,18,21,24-Octaoxaheptacos-26-yn-1-amine |
| IUPAC Name | 2-[2-[2-[2-[2-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine |
| InChI | InChI=1S/C19H37NO8/c1-2-4-21-6-8-23-10-12-25-14-16-27-18-19-28-17-15-26-13-11-24-9-7-22-5-3-20/h1H,3-20H2 |
| InChI Key | HJYYOUVXTIUMEJ-UHFFFAOYSA-N |
| MDL Number | MFCD28334507 |
| Molecular Formula | C19H37NO8 |
| Molecular Weight | 407.4990 |
| SMILES | C(COCCOCCOCCOCCOCCOCCOCCOCC#C)N |
| Synonyms | Propargyl-PEG8-amine,
Propyne-PEG8-amine,
Propyne-PEG8-NH2,
1196732-52-1,
3,6,9,12,15,18,21,24-octaoxaheptacos-26-yn-1-amine,
BIPG1727,
SCHEMBL1491293,
HJYYOUVXTIUMEJ-UHFFFAOYSA-N,
ZINC116334711,
BP-22521,
HC inverted exclamation markOC-CH2-PEG8-NH2,
J-004175,
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| Complexity | 337 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 407.252g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 28 |
| Hydrogen Bond Acceptor Count | 9 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 407.504g/mol |
| Monoisotopic Mass | 407.252g/mol |
| Rotatable Bond Count | 24 |
| Topological Polar Surface Area | 99.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.8 |
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Certificate of Analysis
Lot Number