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Br-PEG4-OH

CAT: 0804-HY-130512-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0804-HY-130512-01Size:1 g
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Description
Br-PEG4-OH is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].
CAS Number
85141-94-2
UNSPSC
12352211
Hazard Statement
H302, H315, H319, H335
Target
PROTAC Linkers
Type
Reference compound
Related Pathways
PROTAC
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/br-peg4-oh.html
Purity
98.16
Solubility
DMSO : 100 mg/mL (ultrasonic)
Smiles
BrCCOCCOCCOCCO
Molecular Formula
C8H17BrO4
Molecular Weight
257.12
Precautions
H302, H315, H319, H335
References & Citations
[1]An S, et al. Small-molecule PROTACs: An emerging and promising approach for the development of targeted therapy drugs. EBioMedicine. 2018 Oct;36:553-562
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
PEG Linkers

Chemical Information

2-(2-(2-(2-Bromoethoxy)ethoxy)ethoxy)ethanol
CAS Number85141-94-2
PubChem CID14786209
IUPAC Name2-[2-[2-(2-bromoethoxy)ethoxy]ethoxy]ethanol
Molecular FormulaC8H17BrO4
Molecular Weight257.12
XLogP-0.1
Topological Polar Surface Area47.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count10
Heavy Atom Count13
Formal Charge0
Complexity92
SMILES
C(COCCOCCOCCBr)O
InChI
InChI=1S/C8H17BrO4/c9-1-3-11-5-7-13-8-6-12-4-2-10/h10H,1-8H2
InChIKey
CERQCRALBKUCTF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(2-(2-(2-Bromoethoxy)ethoxy)ethoxy)ethanol
CAS: 85141-94-2
CID: 14786209
Formula: C8H17BrO4
MW: 257.12
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight257.12
XLogP3-0.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count10
Exact Mass256.03102
Monoisotopic Mass256.03102
Topological Polar Surface Area47.9 Ų
Heavy Atom Count13
Formal Charge0
Complexity92.2
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