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Boc-NH-PEG2-CH2CH2COOH

CAT: 0804-HY-W025812-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W025812-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Boc-NH-PEG2-CH2CH2COOH is a PEG-based PROTAC linker can be used in the synthesis of PROTAC[1].
CAS Number
1365655-91-9
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/boc-nh-peg2-ch2ch2cooh.html
Purity
98.0
Solubility
DMSO : ≥ 100 mg/mL
Smiles
CC(C)(C)OC(NCCOCCOCCC(O)=O)=O
Molecular Formula
C12H23NO6
Molecular Weight
277.31
Precautions
H302, H315, H319, H335
References & Citations
[1]Li Y, et al. Discovery of MD-224 as a First-in-Class, Highly Potent, and Efficacious Proteolysis TargetingChimera Murine Double Minute 2 Degrader Capable of Achieving Complete and Durable TumorRegression. J Med Chem. 2019 Jan 24;62 (2) :448-466.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
Alkyl/ether Linkers; PEG Linkers

Chemical Information

3-[2-(2-{[(Tert-butoxy)carbonyl]amino}ethoxy)ethoxy]propanoic acid
CAS Number1365655-91-9
PubChem CID23591749
IUPAC Name3-[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethoxy]ethoxy]propanoic acid
Molecular FormulaC12H23NO6
Molecular Weight277.31
XLogP0.1
Topological Polar Surface Area94.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count11
Heavy Atom Count19
Formal Charge0
Complexity274
SMILES
CC(C)(C)OC(=O)NCCOCCOCCC(=O)O
InChI
InChI=1S/C12H23NO6/c1-12(2,3)19-11(16)13-5-7-18-9-8-17-6-4-10(14)15/h4-9H2,1-3H3,(H,13,16)(H,14,15)
InChIKey
OZMXZVCAXAQCHJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-[2-(2-{[(Tert-butoxy)carbonyl]amino}ethoxy)ethoxy]propanoic acid
CAS: 1365655-91-9
CID: 23591749
Formula: C12H23NO6
MW: 277.31
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight277.31
XLogP30.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count11
Exact Mass277.15253745
Monoisotopic Mass277.15253745
Topological Polar Surface Area94.1 Ų
Heavy Atom Count19
Formal Charge0
Complexity274
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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