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NH-bis (PEG3-azide)

CAT: 1410-M33443-01Size: 1 EachDry Ice: NoHazardous: No
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Description
NH-bis (PEG3-azide) is a PROTAC linker of the PEG class used in the synthesis of PROTAC molecules.
CAS Number
1258939-39-7
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
419.48
Molecular Formula
C16H33N7O6
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

NH-bis(PEG3-azide)
CAS Number1258939-39-7
PubChem CID123132096
IUPAC Name2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]-N-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethyl]ethanamine
Molecular FormulaC16H33N7O6
Molecular Weight419.48
XLogP0.7
Topological Polar Surface Area96.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count11
Rotatable Bond Count24
Heavy Atom Count29
Formal Charge0
Complexity396
SMILES
C(COCCOCCOCCN=[N+]=[N-])NCCOCCOCCOCCN=[N+]=[N-]
InChI
InChI=1S/C16H33N7O6/c17-22-20-3-7-26-11-15-28-13-9-24-5-1-19-2-6-25-10-14-29-16-12-27-8-4-21-23-18/h19H,1-16H2
InChIKey
APYUGXCRFRUVCL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of NH-bis(PEG3-azide)
CAS: 1258939-39-7
CID: 123132096
Formula: C16H33N7O6
MW: 419.48
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight419.48
XLogP30.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count11
Rotatable Bond Count24
Exact Mass419.24923180
Monoisotopic Mass419.24923180
Topological Polar Surface Area96.1 Ų
Heavy Atom Count29
Formal Charge0
Complexity396
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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