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Propargyl-PEG6-NH2

CAT: 0804-HY-130180-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-130180-01Size:100 mg
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Description
Propargyl-PEG6-NH2 is a PEG-based PROTAC linker can be used in the synthesis of PROTACs[1]. Propargyl-PEG6-NH2 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
1198080-04-4
UNSPSC
12352211
Hazard Statement
H302, 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/propargyl-peg6-nh2.html
Purity
99.69
Solubility
DMSO : 250 mg/mL (ultrasonic)
Smiles
C#CCOCCOCCOCCOCCOCCOCCN
Molecular Formula
C15H29NO6
Molecular Weight
319.39
Precautions
H302, 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
Blue Ice
Storage Conditions
-20°C, 3 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
PEG Linkers

Chemical Information

Propargyl-PEG6-amine
CAS Number1198080-04-4
PubChem CID102514834
IUPAC Name2-[2-[2-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanamine
Molecular FormulaC15H29NO6
Molecular Weight319.39
XLogP-1.5
Topological Polar Surface Area81.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count18
Heavy Atom Count22
Formal Charge0
Complexity256
SMILES
C#CCOCCOCCOCCOCCOCCOCCN
InChI
InChI=1S/C15H29NO6/c1-2-4-17-6-8-19-10-12-21-14-15-22-13-11-20-9-7-18-5-3-16/h1H,3-16H2
InChIKey
USTJDUXGVRIRRT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Propargyl-PEG6-amine
CAS: 1198080-04-4
CID: 102514834
Formula: C15H29NO6
MW: 319.39
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight319.39
XLogP3-1.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count18
Exact Mass319.19948764
Monoisotopic Mass319.19948764
Topological Polar Surface Area81.4 Ų
Heavy Atom Count22
Formal Charge0
Complexity256
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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