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M-PEG9-SH

CAT: 1410-M26979-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1410-M26979-02Size:10 mg
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Description
M-PEG9-SH is a PEG-based PROTAC linker that can be used in the synthesis of PROTAC.
CAS Number
651042-84-1
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
444.58
Molecular Formula
C19H40O9S
Notes
Research use only, not for human use.
Receptor
Proporphyrinogen oxidase (PPO)

Chemical Information

2,5,8,11,14,17,20,23,26-Nonaoxaoctacosane-28-thiol
CAS Number651042-84-1
PubChem CID53400962
IUPAC Name2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanethiol
Molecular FormulaC19H40O9S
Molecular Weight444.6
XLogP-0.8
Topological Polar Surface Area84.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count26
Heavy Atom Count29
Formal Charge0
Complexity288
SMILES
COCCOCCOCCOCCOCCOCCOCCOCCOCCS
InChI
InChI=1S/C19H40O9S/c1-20-2-3-21-4-5-22-6-7-23-8-9-24-10-11-25-12-13-26-14-15-27-16-17-28-18-19-29/h29H,2-19H2,1H3
InChIKey
CDNIDSBAWGKXHY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,5,8,11,14,17,20,23,26-Nonaoxaoctacosane-28-thiol
CAS: 651042-84-1
CID: 53400962
Formula: C19H40O9S
MW: 444.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight444.6
XLogP3-0.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count26
Exact Mass444.23930402
Monoisotopic Mass444.23930402
Topological Polar Surface Area84.1 Ų
Heavy Atom Count29
Formal Charge0
Complexity288
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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