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Bromoacetamido-PEG3-C2-Boc

CAT: 0013-GTR19215884-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19215884-01Size:100 mg
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Description
Bromoacetamido-PEG3-C2-Boc is a polyethylene glycol-based linker used in constructing PROTACs, which are bifunctional molecules for targeted protein degradation. This reagent is employed in both in vitro and in vivo research to develop novel therapeutic strategies by facilitating the assembly of these chimeras.
CAS Number
1807537-33-2
Field of Research
Cell Biology, Pharmacology & Drug Discovery
Smiles
C (OCCOCCOCCNC (CBr) =O) CC (OC (C) (C) C) =O
Molecular Formula
C15H28BrNO6
Molecular Weight
398.29
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Bromoacetamido-PEG3-t-Butyl Ester
CAS Number1807537-33-2
PubChem CID91757751
IUPAC Nametert-butyl 3-[2-[2-[2-[(2-bromoacetyl)amino]ethoxy]ethoxy]ethoxy]propanoate
Molecular FormulaC15H28BrNO6
Molecular Weight398.29
XLogP0.7
Topological Polar Surface Area83.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count15
Heavy Atom Count23
Formal Charge0
Complexity332
SMILES
CC(C)(C)OC(=O)CCOCCOCCOCCNC(=O)CBr
InChI
InChI=1S/C15H28BrNO6/c1-15(2,3)23-14(19)4-6-20-8-10-22-11-9-21-7-5-17-13(18)12-16/h4-12H2,1-3H3,(H,17,18)
InChIKey
QAQLZWBWKHLATI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bromoacetamido-PEG3-t-Butyl Ester
CAS: 1807537-33-2
CID: 91757751
Formula: C15H28BrNO6
MW: 398.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight398.29
XLogP30.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count15
Exact Mass397.11000
Monoisotopic Mass397.11000
Topological Polar Surface Area83.1 Ų
Heavy Atom Count23
Formal Charge0
Complexity332
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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