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Propargyl-PEG2-CH2COOH

CAT: 0804-HY-41922-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-41922-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Propargyl-PEG2-CH2COOH is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1]. Propargyl-PEG2-CH2COOH is a click chemistry reagent, it contains an Alkyne group and can undergo copper-catalyzed azide-alkyne cycloaddition (CuAAc) with molecules containing Azide groups.
CAS Number
944561-46-0
UNSPSC
12352211
Hazard Statement
H315, H318, 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/propargyl-peg2-ch2cooh.html
Purity
95.0
Solubility
10 mM in DMSO
Smiles
O=C(O)COCCOCCOCC#C
Molecular Formula
C9H14O5
Molecular Weight
202.20
Precautions
H315, H318, H335
References & Citations
[1]Guangrong Zheng, et al. Compounds that induce degradation of anti-apoptotic bcl-2 family proteins and the uses thereof. WO2017184995A1.
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, stored under nitrogen)
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
PEG Linkers

Chemical Information

2-{2-[2-(Prop-2-yn-1-yloxy)ethoxy]ethoxy}acetic acid
CAS Number944561-46-0
PubChem CID58281034
IUPAC Name2-[2-(2-prop-2-ynoxyethoxy)ethoxy]acetic acid
Molecular FormulaC9H14O5
Molecular Weight202.20
XLogP-0.5
Topological Polar Surface Area65
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Heavy Atom Count14
Formal Charge0
Complexity193
SMILES
C#CCOCCOCCOCC(=O)O
InChI
InChI=1S/C9H14O5/c1-2-3-12-4-5-13-6-7-14-8-9(10)11/h1H,3-8H2,(H,10,11)
InChIKey
FWONAGPFSKACQC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-{2-[2-(Prop-2-yn-1-yloxy)ethoxy]ethoxy}acetic acid
CAS: 944561-46-0
CID: 58281034
Formula: C9H14O5
MW: 202.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight202.20
XLogP3-0.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Exact Mass202.08412354
Monoisotopic Mass202.08412354
Topological Polar Surface Area65 Ų
Heavy Atom Count14
Formal Charge0
Complexity193
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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