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Benzyl-PEG8-alcohol

CAT: 0931-T40571-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T40571-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
477775-73-8
Target
PROTAC Linker, Others
Related Pathways
Others, PROTAC
Bioactivity
Benzyl-PEG8-alcohol, 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
C(OCCOCCOCCOCCOCCOCCOCCOCCO)C1=CC=CC=C1
Molecular Formula
C23H40O9
Molecular Weight
460.56
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1-Phenyl-2,5,8,11,14,17,20,23-octaoxapentacosan-25-ol
CAS Number477775-73-8
PubChem CID57437703
IUPAC Name2-[2-[2-[2-[2-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
Molecular FormulaC23H40O9
Molecular Weight460.6
XLogP-0.1
Topological Polar Surface Area94.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count25
Heavy Atom Count32
Formal Charge0
Complexity354
SMILES
C1=CC=C(C=C1)COCCOCCOCCOCCOCCOCCOCCOCCO
InChI
InChI=1S/C23H40O9/c24-6-7-25-8-9-26-10-11-27-12-13-28-14-15-29-16-17-30-18-19-31-20-21-32-22-23-4-2-1-3-5-23/h1-5,24H,6-22H2
InChIKey
KFJXPXAFUAPRSZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Phenyl-2,5,8,11,14,17,20,23-octaoxapentacosan-25-ol
CAS: 477775-73-8
CID: 57437703
Formula: C23H40O9
MW: 460.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight460.6
XLogP3-0.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count25
Exact Mass460.26723285
Monoisotopic Mass460.26723285
Topological Polar Surface Area94.1 Ų
Heavy Atom Count32
Formal Charge0
Complexity354
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