HO-PEG13-OH - ≥95% , CAS No.17598-96-8

CAS: 17598-96-8 Cat. No.: H412730 Formule: C₂₆H₅₄O₁₄ Poids moléculaire: 590.70

GRADE & PURITY ≥95%

Synonyms

D84631 | EINECS 241-569-7 | 3,6,9,12,15,18,21,24,27,30,33,36-Dodecaoxaoctatriacontane-1,38-diol | DTXSID80170053 | PEG-14 | Q27453514 | 33O | BP-20952 | HY-141234 | SY272911 | AKOS040743357 | BS-44478 | HO-PEG13-OH | SCHEMBL3680604 | tridecaethyleneglycol

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Vue d’ensemble

​HO-PEG13-OH is a PROTAC linker belonging to the PEG class. It can be used to synthesize PROTAC molecules

Specifications

Synonymes

D84631 | EINECS 241-569-7 | 3,6,9,12,15,18,21,24,27,30,33,36-Dodecaoxaoctatriacontane-1,38-diol | DTXSID80170053 | PEG-14 | Q27453514 | 33O | BP-20952 | HY-141234 | SY272911 | AKOS040743357 | BS-44478 | HO-PEG13-OH | SCHEMBL3680604 | tridecaethyleneglycol

Spécifications et pureté

≥95%

Mécanismes biochimiques et physiologiques

HO-PEG13-OH is a PEG-based PROTAC linker that is applicable to the synthesis of PROTACs.

Conditions de stockage de stockage

Store at -20°C

Expédié en

Ice chest + Ice pads

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥95%

Noms et identifiants

Pubchem Sid

528764811

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/528764811

Sourires canoniques

C(COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)O

IUPAC Name

2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol

InChIKey

AKWFJQNBHYVIPY-UHFFFAOYSA-N

INCHI

1S/C26H54O14/c27-1-3-29-5-7-31-9-11-33-13-15-35-17-19-37-21-23-39-25-26-40-24-22-38-20-18-36-16-14-34-12-10-32-8-6-30-4-2-28/h27-28H,1-26H2

Isomères SMILES

C(COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO)O

Poids moléculaire

590.70

Reaxy-Rn

4213451

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4213451&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Dialkyl ethers
• Direct Parent: Polyethylene glycols
• Alternative Parents: Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Polyethylene glycol - Hydrocarbon derivative - Primary alcohol - Alcohol - Aliphatic acyclic compound
• Description: 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

Propriétés chimiques et physiques

• Solubilité: Solubility (25°C) In vitro
• Poids moléculaire: 590.700 g/mol
• XLogP3: -2.900
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 37
• Exact Mass: 590.351 Da
• Monoisotopic Mass: 590.351 Da
• Topological Polar Surface Area: 151.000 Ų
• Heavy Atom Count: 40
• Formal Charge: 0
• Complexity: 398.000
• 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