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Br-C2-PEG3-OTs

CAT: 0013-GTR19263913-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19263913-02Size:10 mg
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Description
Br-C2-PEG3-OTs is classified as a PROTAC linker within the PEG category, and it is utilized for the synthesis of PROTAC molecules, such as PROTACSTINGdegrader-4.
CAS Number
2757925-36-1
Field of Research
Cell Biology, Pharmacology & Drug Discovery
Smiles
O=S (=O) (OCCOCCOCCOCCBr) C1=CC=C (C=C1) C
Molecular Formula
C15H23BrO6S
Molecular Weight
411.31
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-{2-[2-(2-Bromoethoxy)ethoxy]ethoxy}ethyl 4-methylbenzene-1-sulfonate
CAS Number2757925-36-1
PubChem CID165766559
IUPAC Name2-[2-[2-(2-bromoethoxy)ethoxy]ethoxy]ethyl 4-methylbenzenesulfonate
Molecular FormulaC15H23BrO6S
Molecular Weight411.3
XLogP1.8
Topological Polar Surface Area79.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count13
Heavy Atom Count23
Formal Charge0
Complexity376
SMILES
CC1=CC=C(C=C1)S(=O)(=O)OCCOCCOCCOCCBr
InChI
InChI=1S/C15H23BrO6S/c1-14-2-4-15(5-3-14)23(17,18)22-13-12-21-11-10-20-9-8-19-7-6-16/h2-5H,6-13H2,1H3
InChIKey
LENLLEVKRXCZKF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-{2-[2-(2-Bromoethoxy)ethoxy]ethoxy}ethyl 4-methylbenzene-1-sulfonate
CAS: 2757925-36-1
CID: 165766559
Formula: C15H23BrO6S
MW: 411.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight411.3
XLogP31.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count13
Exact Mass410.03987
Monoisotopic Mass410.03987
Topological Polar Surface Area79.4 Ų
Heavy Atom Count23
Formal Charge0
Complexity376
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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