3,7-Dioxa-1,9-nonanediol - ≥97%(GC) , CAS No.67439-82-1

CAS: 67439-82-1 Cat. No.: D465329 Summenformel: C₇H₁₆O₄ Molekulargewicht: 164.2 EG-Nummer: 636-166-1

GRADE & PURITY ≥97%(GC)

Synonyms

2,2'-(Trimethylenedioxy)diethanol | 2-[3-(2-hydroxyethoxy)propoxy]ethanol | 3,7-dioxanonane-1,9-diol | 2-[3-(2-hydroxyethoxy)propoxy]ethan-1-ol | HY-W096121 | PEG3 | 3,7-Dioxa-1,9-nonanediol | 1,9-Dihydroxy-3,7-dioxanonane | SCHEMBL651261 | DTXSID00432786

Storage

Argon charged,Room temperature

Shipped In

Normal

Übersicht

PEG3 is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs.

Specifications

Synonyme

2,2'-(Trimethylenedioxy)diethanol | 2-[3-(2-hydroxyethoxy)propoxy]ethanol | 3,7-dioxanonane-1,9-diol | 2-[3-(2-hydroxyethoxy)propoxy]ethan-1-ol | HY-W096121 | PEG3 | 3,7-Dioxa-1,9-nonanediol | 1,9-Dihydroxy-3,7-dioxanonane | SCHEMBL651261 | DTXSID00432786

Spezifikationen & Reinheit

≥97%(GC)

Storage

Argon charged,Room temperature

Verschickt in

Normal

Reinheit

≥97%(GC)

Namen und Kennungen

• Pubchem Sid: 488196429
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488196429
• Kanonisches Lächeln: C(COCCO)COCCO
• IUPAC Name: 2-[3-(2-hydroxyethoxy)propoxy]ethanol
• InChIKey: KXSKAZFMTGADIV-UHFFFAOYSA-N
• INCHI: 1S/C7H16O4/c8-2-6-10-4-1-5-11-7-3-9/h8-9H,1-7H2
• Isomere SMILES: C(COCCO)COCCO
• WGK Deutschland: 3
• Molekulargewicht: 164.2
• Reaxy-Rn: 1742743
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1742743&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Klasse Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Klasse: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Dialkyl ethers
• Alternative Parents: Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Dialkyl ether - Hydrocarbon derivative - Primary alcohol - Alcohol - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as dialkyl ethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are alkyl groups.
• 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

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Moisture sensitive
• Brechungsindex: 1.456
• Molekulargewicht: 164.200 g/mol
• XLogP3: -1.100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 164.105 Da
• Monoisotopic Mass: 164.105 Da
• Topological Polar Surface Area: 58.900 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 59.500
• 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

Häufig gestellte Fragen

What is the purity of this product, and how is it determined?

This product is supplied at ≥97% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 67439-82-1, the molecular formula is C7H16O4, and the molecular weight is 164.2 g/mol. InChIKey KXSKAZFMTGADIV-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.