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S-acetyl-PEG5-alcohol

CAT: 0931-T38390-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T38390-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1000415-61-1
Target
Others, PROTAC Linker
Related Pathways
PROTAC, Others
Bioactivity
S-acetyl-PEG5-alcohol is a PEG-based linker for PROTACs that joins two essential ligands, facilitating selective protein degradation via the ubiquitin-proteasome system within cells.
Smiles
CC(=O)SCCOCCOCCOCCOCCO
Molecular Formula
C12H24O6S
Molecular Weight
296.38
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

S-acetyl-PEG5-alcohol
CAS Number1000415-61-1
PubChem CID58879706
IUPAC NameS-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate
Molecular FormulaC12H24O6S
Molecular Weight296.38
XLogP-0.6
Topological Polar Surface Area99.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count15
Heavy Atom Count19
Formal Charge0
Complexity203
SMILES
CC(=O)SCCOCCOCCOCCOCCO
InChI
InChI=1S/C12H24O6S/c1-12(14)19-11-10-18-9-8-17-7-6-16-5-4-15-3-2-13/h13H,2-11H2,1H3
InChIKey
QJGLHDQKAASANO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of S-acetyl-PEG5-alcohol
CAS: 1000415-61-1
CID: 58879706
Formula: C12H24O6S
MW: 296.38
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight296.38
XLogP3-0.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count15
Exact Mass296.12935965
Monoisotopic Mass296.12935965
Topological Polar Surface Area99.5 Ų
Heavy Atom Count19
Formal Charge0
Complexity203
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