13-Chloro-1-phenyl-2,5,8,11-tetraoxatridecane

Base Information

• Chemical Name: 13-Chloro-1-phenyl-2,5,8,11-tetraoxatridecane
• CAS No.: 105891-51-8
• Molecular Formula: C15H23ClO4
• Molecular Weight: 302.798
• DSSTox Substance ID: DTXSID70543656
• Wikidata: Q82420595
• Mol file: 105891-51-8.mol

Synonyms:105891-51-8;13-CHLORO-1-PHENYL-2,5,8,11-TETRAOXATRIDECANE;DTXSID70543656

Chemical Property of 13-Chloro-1-phenyl-2,5,8,11-tetraoxatridecane

Chemical Property:

• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 13
• Exact Mass: 302.1284869
• Heavy Atom Count: 20
• Complexity: 198

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COCCOCCOCCOCCCl

Technology Process of 13-Chloro-1-phenyl-2,5,8,11-tetraoxatridecane

There total 9 articles about 13-Chloro-1-phenyl-2,5,8,11-tetraoxatridecane which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 96.0%

1-phenyl-2,5,8,11-tetraoxatridecan-13-ol (86259-87-2,1201808-31-2) → (2-{2-[2-(2-Chloro-ethoxy)-ethoxy]-ethoxy}-ethoxymethyl)-benzene (105891-51-8)

Guidance literature:

With triphenylphosphine; In tetrachloromethane; for 24h; Heating;

Reference yield: 36.0%

1-phenyl-2,5,8,11,14,17-hexaoxanonadecan-19-ol (24342-68-5,1201808-31-2) → (2-{2-[2-(2-Chloro-ethoxy)-ethoxy]-ethoxy}-ethoxymethyl)-benzene (105891-51-8) + {2-[2-(2-{2-[2-(2-Chloro-ethoxy)-ethoxy]-ethoxy}-ethoxy)-ethoxy]-ethoxymethyl}-benzene

Guidance literature:

With thionyl chloride;

DOI:10.1021/jo035042v

Reference yield:

Tetraethylene glycol (112-60-7) → (2-{2-[2-(2-Chloro-ethoxy)-ethoxy]-ethoxy}-ethoxymethyl)-benzene (105891-51-8)

Guidance literature:

Multi-step reaction with 2 steps

1: NaH / tetrahydrofuran / 3 h / 100 °C

2: pyridine; thionyl chloride / CHCl₃ / 6 h / Heating

With pyridine; thionyl chloride; sodium hydride; In tetrahydrofuran; chloroform;

DOI:10.1021/jo0617464

upstream raw materials:

1-phenyl-2,5,8,11-tetraoxatridecan-13-ol

1-phenyl-2,5,8,11,14,17-hexaoxanonadecan-19-ol

Tetraethylene glycol

benzyl chloride

Downstream raw materials:

1,27-diphenyl-2,5,8,11,14,17,20,23,26-nonaoxaheptacosane

C₃₂H₅₀O₁₀

[2-(2-{2-[2-(2,2,3,3,4,4,5,5,6,6,7,7,7-Tridecafluoro-heptyloxy)-ethoxy]-ethoxy}-ethoxy)-ethoxymethyl]-benzene

[2-(2-{2-[2-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Pentadecafluoro-octyloxy)-ethoxy]-ethoxy}-ethoxy)-ethoxymethyl]-benzene