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Bis-PEG5-PFP ester

CAT: 0931-T14644-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0931-T14644-02Size:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1334177-78-4
Target
Others, PROTAC Linker
Related Pathways
PROTAC, Others
Bioactivity
Bis-PEG5-PFP ester, a PEG-based linker for PROTACs, joins two essential ligands crucial for forming PROTAC molecules, enabling selective protein degradation by leveraging the ubiquitin-proteasome system within cells.
Smiles
O=C(OC=1C(F)=C(F)C(F)=C(F)C1F)CCOCCOCCOCCOCCOCCC(=O)OC=2C(F)=C(F)C(F)=C(F)C2F
Molecular Formula
C26H24F10O9
Molecular Weight
670.45
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Bis-PEG5-PFP ester
CAS Number1334177-78-4
PubChem CID53486136
IUPAC Name(2,3,4,5,6-pentafluorophenyl) 3-[2-[2-[2-[2-[3-oxo-3-(2,3,4,5,6-pentafluorophenoxy)propoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoate
Molecular FormulaC26H24F10O9
Molecular Weight670.4
XLogP3.3
Topological Polar Surface Area98.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count19
Rotatable Bond Count22
Heavy Atom Count45
Formal Charge0
Complexity770
SMILES
C(COCCOCCOCCOCCOCCC(=O)OC1=C(C(=C(C(=C1F)F)F)F)F)C(=O)OC2=C(C(=C(C(=C2F)F)F)F)F
InChI
InChI=1S/C26H24F10O9/c27-15-17(29)21(33)25(22(34)18(15)30)44-13(37)1-3-39-5-7-41-9-11-43-12-10-42-8-6-40-4-2-14(38)45-26-23(35)19(31)16(28)20(32)24(26)36/h1-12H2
InChIKey
PVXXABBOISIWMS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bis-PEG5-PFP ester
CAS: 1334177-78-4
CID: 53486136
Formula: C26H24F10O9
MW: 670.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight670.4
XLogP33.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count19
Rotatable Bond Count22
Exact Mass670.12606396
Monoisotopic Mass670.12606396
Topological Polar Surface Area98.8 Ų
Heavy Atom Count45
Formal Charge0
Complexity770
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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572954Bis-PEG7-PFP ester
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