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Aminooxy-PEG3-acid

CAT: 0804-HY-140005-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-140005-01Size:50 mg
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Description
Aminooxy-PEG3-acid is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].
CAS Number
1807540-79-9
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/aminooxy-peg3-acid.html
Purity
95.0
Solubility
DMSO : ≥ 250 mg/mL
Smiles
O=C(O)CCOCCOCCOCCON
Molecular Formula
C9H19NO6
Molecular Weight
237.25
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
Blue Ice
Storage Conditions
-20°C, 3 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
PEG Linkers

Chemical Information

Aminooxy-PEG3-acid
CAS Number1807540-79-9
PubChem CID77078369
IUPAC Name3-[2-[2-(2-aminooxyethoxy)ethoxy]ethoxy]propanoic acid
Molecular FormulaC9H19NO6
Molecular Weight237.25
XLogP-3.9
Topological Polar Surface Area100
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count12
Heavy Atom Count16
Formal Charge0
Complexity166
SMILES
C(COCCOCCOCCON)C(=O)O
InChI
InChI=1S/C9H19NO6/c10-16-8-7-15-6-5-14-4-3-13-2-1-9(11)12/h1-8,10H2,(H,11,12)
InChIKey
HCDJNGXHQUUUCA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Aminooxy-PEG3-acid
CAS: 1807540-79-9
CID: 77078369
Formula: C9H19NO6
MW: 237.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight237.25
XLogP3-3.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count12
Exact Mass237.12123733
Monoisotopic Mass237.12123733
Topological Polar Surface Area100 Ų
Heavy Atom Count16
Formal Charge0
Complexity166
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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