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Boc-NH-PEG11-NH2

CAT: 1410-M26919-01Size: 1 EachDry Ice: NoHazardous: No
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Description
Boc-NH-PEG11-NH2 is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs.
CAS Number
1233234-77-9
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
644.79
Molecular Formula
C29H60N2O13
Notes
Research use only, not for human use.
Receptor
——

Chemical Information

Boc-PEG-amine (n=11)
CAS Number1233234-77-9
PubChem CID5079724
IUPAC Nametert-butyl N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]carbamate
Molecular FormulaC29H60N2O13
Molecular Weight644.8
XLogP-1.6
Topological Polar Surface Area166
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count14
Rotatable Bond Count37
Heavy Atom Count44
Formal Charge0
Complexity586
SMILES
CC(C)(C)OC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCN
InChI
InChI=1S/C29H60N2O13/c1-29(2,3)44-28(32)31-5-7-34-9-11-36-13-15-38-17-19-40-21-23-42-25-27-43-26-24-41-22-20-39-18-16-37-14-12-35-10-8-33-6-4-30/h4-27,30H2,1-3H3,(H,31,32)
InChIKey
GISRSYIQHFGCMC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Boc-PEG-amine (n=11)
CAS: 1233234-77-9
CID: 5079724
Formula: C29H60N2O13
MW: 644.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight644.8
XLogP3-1.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count14
Rotatable Bond Count37
Exact Mass644.40953997
Monoisotopic Mass644.40953997
Topological Polar Surface Area166 Ų
Heavy Atom Count44
Formal Charge0
Complexity586
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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