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Aminooxy-PEG4-propargyl

CAT: 0804-HY-140058Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-140058Size:250 mg
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Description
Aminooxy-PEG4-propargyl is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1]. Aminooxy-PEG4-propargyl 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
1835759-78-8
UNSPSC
12352211
Hazard Statement
H315, H319
Target
PROTAC Linkers
Type
Reference compound
Related Pathways
PROTAC
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/aminooxy-peg4-propargyl.html
Purity
98.0
Solubility
10 mM in DMSO
Smiles
NOCCOCCOCCOCCOCC#C
Molecular Formula
C11H21NO5
Molecular Weight
247.29
Precautions
H315, H319
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
4°C (Powder, sealed storage, away from moisture and light)
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
PEG Linkers

Chemical Information

Aminooxy-PEG4-Propargyl
CAS Number1835759-78-8
PubChem CID87405402
IUPAC NameO-[2-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]ethyl]hydroxylamine
Molecular FormulaC11H21NO5
Molecular Weight247.29
XLogP-1.1
Topological Polar Surface Area72.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count13
Heavy Atom Count17
Formal Charge0
Complexity192
SMILES
C#CCOCCOCCOCCOCCON
InChI
InChI=1S/C11H21NO5/c1-2-3-13-4-5-14-6-7-15-8-9-16-10-11-17-12/h1H,3-12H2
InChIKey
BGPKKFCCGOYRRN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Aminooxy-PEG4-Propargyl
CAS: 1835759-78-8
CID: 87405402
Formula: C11H21NO5
MW: 247.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight247.29
XLogP3-1.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count13
Exact Mass247.14197277
Monoisotopic Mass247.14197277
Topological Polar Surface Area72.2 Ų
Heavy Atom Count17
Formal Charge0
Complexity192
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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