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1,1,1-Trifluoroethyl-PEG4-amine

CAT: 0931-T13986-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T13986-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1872433-72-1
Target
Others, PROTAC Linker
Related Pathways
PROTAC, Others
Bioactivity
111-Trifluoroethyl-PEG4-amine is a polyethylene glycol (PEG) -based linker appropriate for synthesizing proteolysis-targeting chimeras (PROTACs) [1].
Smiles
FC(F)(F)COCCOCCOCCOCCN
Molecular Formula
C10H20F3NO4
Molecular Weight
275.27
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1,1,1-Trifluoroethyl-PEG4-amine
CAS Number1872433-72-1
PubChem CID119058293
IUPAC Name2-[2-[2-[2-(2,2,2-trifluoroethoxy)ethoxy]ethoxy]ethoxy]ethanamine
Molecular FormulaC10H20F3NO4
Molecular Weight275.27
XLogP-0.2
Topological Polar Surface Area62.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count12
Heavy Atom Count18
Formal Charge0
Complexity181
SMILES
C(COCCOCCOCCOCC(F)(F)F)N
InChI
InChI=1S/C10H20F3NO4/c11-10(12,13)9-18-8-7-17-6-5-16-4-3-15-2-1-14/h1-9,14H2
InChIKey
JVFYELHCDPCZQY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,1,1-Trifluoroethyl-PEG4-amine
CAS: 1872433-72-1
CID: 119058293
Formula: C10H20F3NO4
MW: 275.27
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight275.27
XLogP3-0.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count12
Exact Mass275.13444261
Monoisotopic Mass275.13444261
Topological Polar Surface Area62.9 Ų
Heavy Atom Count18
Formal Charge0
Complexity181
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