| CAS Number | 1807539-02-1 |
| Catalog Number | AG00I092(AGN-PC-0WR0LI) |
| Chemical Name | Bis-PEG1-PFP ester |
| IUPAC Name | (2,3,4,5,6-pentafluorophenyl) 3-[3-oxo-3-(2,3,4,5,6-pentafluorophenoxy)propoxy]propanoate |
| InChI | InChI=1S/C18H8F10O5/c19-7-9(21)13(25)17(14(26)10(7)22)32-5(29)1-3-31-4-2-6(30)33-18-15(27)11(23)8(20)12(24)16(18)28/h1-4H2 |
| InChI Key | PACGANKFUNUYHE-UHFFFAOYSA-N |
| MDL Number | MFCD26127804 |
| Molecular Formula | C18H8F10O5 |
| Molecular Weight | 494.2372 |
| SMILES | O=C(OC=1C(F)=C(F)C(F)=C(F)C1F)CCOCCC(=O)OC=2C(F)=C(F)C(F)=C(F)C2F |
| Synonyms | Bis-PEG1-PFP ester,
1807539-02-1,
SCHEMBL15119243,
ZINC110715844,
BP-21833,
|
| Complexity | 589 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 494.021205g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 33 |
| Hydrogen Bond Acceptor Count | 15 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 494.2g/mol |
| Monoisotopic Mass | 494.021205g/mol |
| Rotatable Bond Count | 10 |
| Topological Polar Surface Area | 61.8Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number