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Methylamino-PEG2-acid

CAT: 0804-HY-140153-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-140153-01Size:1 mg
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Description
Methylamino-PEG2-acid is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].
CAS Number
1807503-87-2
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/methylamino-peg2-acid.html
Solubility
10 mM in DMSO
Smiles
O=C(O)CCOCCOCCNC
Molecular Formula
C8H17NO4
Molecular Weight
191.22
Precautions
P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501
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
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
PEG Linkers

Chemical Information

Methylamino-PEG2-acid
CAS Number1807503-87-2
PubChem CID86291521
IUPAC Name3-[2-[2-(methylamino)ethoxy]ethoxy]propanoic acid
Molecular FormulaC8H17NO4
Molecular Weight191.22
XLogP-3.3
Topological Polar Surface Area67.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Heavy Atom Count13
Formal Charge0
Complexity129
SMILES
CNCCOCCOCCC(=O)O
InChI
InChI=1S/C8H17NO4/c1-9-3-5-13-7-6-12-4-2-8(10)11/h9H,2-7H2,1H3,(H,10,11)
InChIKey
NZAMTZREVKICMJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methylamino-PEG2-acid
CAS: 1807503-87-2
CID: 86291521
Formula: C8H17NO4
MW: 191.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight191.22
XLogP3-3.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Exact Mass191.11575802
Monoisotopic Mass191.11575802
Topological Polar Surface Area67.8 Ų
Heavy Atom Count13
Formal Charge0
Complexity129
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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Alternative Products

CatalogName
MBS5769505Methylamino-PEG2-acid
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572635Methylamino-PEG2-t-butyl ester
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