| CAS Number | 1334170-00-1 |
| Catalog Number | AG00HSWB(AGN-PC-0WGEUI) |
| Chemical Name | Bis-peg13-pfp ester |
| IUPAC Name | (2,3,4,5,6-pentafluorophenyl) 3-[2-[2-[2-[2-[2-[2-[2-[2-[3-oxo-3-(2,3,4,5,6-pentafluorophenoxy)propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoate |
| InChI | InChI=1S/C34H40F10O13/c35-23-25(37)29(41)33(30(42)26(23)38)56-21(45)1-3-47-5-7-49-9-11-51-13-15-53-17-19-55-20-18-54-16-14-52-12-10-50-8-6-48-4-2-22(46)57-34-31(43)27(39)24(36)28(40)32(34)44/h1-20H2 |
| InChI Key | OFZQOXAQZALFLN-UHFFFAOYSA-N |
| MDL Number | MFCD20926401 |
| Molecular Formula | C34H40F10O13 |
| Molecular Weight | 846.6576 |
| SMILES | C(COCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)OC1=C(C(=C(C(=C1F)F)F)F)F)C(=O)OC2=C(C(=C(C(=C2F)F)F)F)F |
| Synonyms | Bis-PEG9-PFP ester,
1334170-00-1,
Bis-dPEG(R)9-PFP ester,
MFCD20926401,
AKOS030213635,
ZINC150338868,
BP-20446,
alpha,omega-Bis(pentafluorphenyl propionate) nona(ethylene glycol),
|
| Complexity | 956 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 846.231g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 57 |
| Hydrogen Bond Acceptor Count | 23 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 846.665g/mol |
| Monoisotopic Mass | 846.231g/mol |
| Rotatable Bond Count | 34 |
| Topological Polar Surface Area | 136A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number