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Boc-NH-PEG12-NH2

CAT: 0013-GTR19177728Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19177728Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Boc-NH-PEG12-NH2 is a heterobifunctional PEG linker used in constructing PROTAC molecules for targeted protein degradation. Its extended, flexible spacer is crucial for facilitating ternary complex formation in both cellular and in vivo studies, enabling research across oncology and neurology.
CAS Number
1642551-09-4
Product Name Alternative
Inhibitor, inhibit, NHBoc-PEG12-amine, BocNHPEG12NH2, Boc-NH-PEG-12-NH2, Boc-NH-PEG12-NH2, Boc NH PEG12 NH2, PEGs, PROTAC Linker, PROTAC Linkers, PROTACLinker
Field of Research
Pharmacology & Drug Discovery
Purity
99.52% (May vary between batches)
Smiles
C (COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCN) OCCNC (OC (C) (C) C) =O
Molecular Formula
C31H64N2O14
Molecular Weight
688.84
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

BocNH-PEG12-CH2CH2NH2
CAS Number1642551-09-4
PubChem CID137346699
IUPAC Nametert-butyl N-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]carbamate
Molecular FormulaC31H64N2O14
Molecular Weight688.8
XLogP-1.8
Topological Polar Surface Area175
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count15
Rotatable Bond Count40
Heavy Atom Count47
Formal Charge0
Complexity632
SMILES
CC(C)(C)OC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCN
InChI
InChI=1S/C31H64N2O14/c1-31(2,3)47-30(34)33-5-7-36-9-11-38-13-15-40-17-19-42-21-23-44-25-27-46-29-28-45-26-24-43-22-20-41-18-16-39-14-12-37-10-8-35-6-4-32/h4-29,32H2,1-3H3,(H,33,34)
InChIKey
USZAQHILQQTIAZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of BocNH-PEG12-CH2CH2NH2
CAS: 1642551-09-4
CID: 137346699
Formula: C31H64N2O14
MW: 688.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight688.8
XLogP3-1.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count15
Rotatable Bond Count40
Exact Mass688.43575472
Monoisotopic Mass688.43575472
Topological Polar Surface Area175 Ų
Heavy Atom Count47
Formal Charge0
Complexity632
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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