Thiol-PEG4-alcohol - ≥95% , CAS No.90952-27-5

CAS: 90952-27-5 Cat. No.: T597510 Peso molecular: 210.29 Número EC: 804-584-5

GRADE & PURITY ≥95%

Synonyms

1-mercapto-11-hydroxy-3,6,9-trioxaundecane | 2-{2-[2-(2-Mercaptoethoxy)ethoxy]ethoxy}ethanol | 2-{2-[2-(2-Mercapto-ethoxy)-ethoxy]-ethoxy}-ethanol | DTXSID40440360 | HY-133292 | MFCD22574773 | SCHEMBL3909088 | Thiol-PEG4-Alcohol | BP-20960 | SH-PEG4-OH |

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Descripción general

Thiol-PEG4-alcohol is a PEG-based linker for PROTACs which joins two essential ligands, crucial for forming PROTAC molecules. This linker enables selective protein degradation by leveraging the ubiquitin-proteasome system within cells.

Specifications

Sinónimos

1-mercapto-11-hydroxy-3, 6, 9-trioxaundecane | 2-{2-[2-(2-Mercaptoethoxy)ethoxy]ethoxy}ethanol | 2-{2-[2-(2-Mercapto-ethoxy)-ethoxy]-ethoxy}-ethanol | DTXSID40440360 | HY-133292 | MFCD22574773 | SCHEMBL3909088 | Thiol-PEG4-Alcohol | BP-20960 | SH-PEG4-OH |

Especificaciones y pureza

≥95%

Mecanismos bioquímicos y fisiológicos

Thiol-PEG4-alcohol is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs

Condiciones de almacenamiento de almacenamiento

Store at -20°C, Argon charged

Enviado en

Ice chest + Ice pads

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥95%

Nombres e identificadores

• Sonrisas canónicas: C(COCCOCCOCCS)O
• IUPAC Name: 2-[2-[2-(2-sulfanylethoxy)ethoxy]ethoxy]ethanol
• InChIKey: GKKYNULPAQDGHI-UHFFFAOYSA-N
• INCHI: 1S/C8H18O4S/c9-1-2-10-3-4-11-5-6-12-7-8-13/h9,13H,1-8H2
• Isómeros SMILES: C(COCCOCCOCCS)O
• Peso molecular: 210.29
• Reaxy-Rn: 8409922
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8409922&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Clase Organooxygen compounds
      • Subclass Ethers
        • Level5 Dialkyl ethers
          • Level6 Polyethylene glycols

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Dialkyl ethers
• Direct Parent: Polyethylene glycols
• Alternative Parents: Alkylthiols Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Polyethylene glycol - Alkylthiol - Hydrocarbon derivative - Primary alcohol - Organosulfur compound - Alcohol - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as polyethylene glycols. These are oligomers or polymers of ethylene oxide, with the general formula (C2H4O)n (with n>=3).
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propiedades químicas y físicas

• Sensibilidad: Air sensitive；Moisture sensitive
• Índice de refracción: 1.481
• Peso molecular: 210.290 g/mol
• XLogP3: -0.600
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 10
• Exact Mass: 210.093 Da
• Monoisotopic Mass: 210.093 Da
• Topological Polar Surface Area: 48.900 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 92.200
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1