Ethanol, 2,2'-((1-((2-propenyloxy)methyl)-1,2-ethanediyl]bis(oxy))bis-, bis(4-methylbenzenesulfonate)

Base Information

• Chemical Name: Ethanol, 2,2'-((1-((2-propenyloxy)methyl)-1,2-ethanediyl]bis(oxy))bis-, bis(4-methylbenzenesulfonate)
• CAS No.: 114719-15-2
• Molecular Formula: C₂₄H₃₂O₉S₂
• Molecular Weight: 528.645
• DSSTox Substance ID: DTXSID501108993
• Mol file: 114719-15-2.mol

Synonyms:114719-15-2;Ethanol, 2,2'-((1-((2-propenyloxy)methyl)-1,2-ethanediyl]bis(oxy))bis-, bis(4-methylbenzenesulfonate);4-allyloxymethyl-3,6-dioxa-1,8-octanediol ditosylate;((3-(Allyloxy)propane-1,2-diyl)bis(oxy))bis(ethane-2,1-diyl) bis(4-methylbenzenesulfonate);2-[2-[2-(4-methylphenyl)sulfonyloxyethoxy]-3-prop-2-enoxypropoxy]ethyl 4-methylbenzenesulfonate;[[3-(Allyloxy)propane-1,2-diyl]bis(oxy)]bis(ethane-2,1-diyl) Bis(4-methylbenzenesulfonate);Ethanol, 2,2'-[[1-[(2-propenyloxy)methyl]-1,2-ethanediyl]bis(oxy)]bis-, bis(4-methylbenzenesulfonate);DTXSID501108993;MFCD34182096;SY333418;WS-00517;E72569;Ethanol, 2,2'-[[1-[(2-propen-1-yloxy)methyl]-1,2-ethanediyl]bis(oxy)]bis-, 1,1'-bis(4-methylbenzenesulfonate)

Chemical Property of Ethanol, 2,2'-((1-((2-propenyloxy)methyl)-1,2-ethanediyl]bis(oxy))bis-, bis(4-methylbenzenesulfonate)

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 646.331°C at 760 mmHg
• Flash Point: 344.689°C
• Density: 1.242g/cm³
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 17
• Exact Mass: 528.14877494
• Heavy Atom Count: 35
• Complexity: 786

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCCOCC(COCC=C)OCCOS(=O)(=O)C2=CC=C(C=C2)C

Technology Process of Ethanol, 2,2'-((1-((2-propenyloxy)methyl)-1,2-ethanediyl]bis(oxy))bis-, bis(4-methylbenzenesulfonate)

There total 1 articles about Ethanol, 2,2'-((1-((2-propenyloxy)methyl)-1,2-ethanediyl]bis(oxy))bis-, bis(4-methylbenzenesulfonate) 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: 60.0%

3,6-dioxa-4-<(allyloxy)methyl>-1,8-octanediol (107106-38-7) + p-toluenesulfonyl chloride (98-59-9) → 4-<(allyloxy)methyl>-3,6-dioxa-1,8-octanediol ditosylate (114719-15-2)

Guidance literature:

With pyridine; Ambient temperature;

DOI:10.1021/jo00249a012

Reference yield:

4-<(allyloxy)methyl>-3,6-dioxa-1,8-octanediol ditosylate (114719-15-2) → 5-<(allyloxy)methyl>-1,10-dibenzyl-4,7,13,16-tetraoxa-1,10-diazacyclooctadecane (114719-03-8)

Guidance literature:

Multi-step reaction with 2 steps

1: 80 percent / NaI, Na₂CO₃ / acetone / 24 h / Heating

2: 80 percent / NaI, Na₂CO₃ / acetonitrile / 25 h / Heating

With sodium carbonate; sodium iodide; In acetone; acetonitrile;

DOI:10.1021/jo00249a012

Reference yield:

1,8-Dihydroxy-3,6-dibenzyl-3,6-diazaoctane (30933-25-6) + 4-<(allyloxy)methyl>-3,6-dioxa-1,8-octanediol ditosylate (114719-15-2) → 11-Allyloxymethyl-1,4-dibenzyl-1,4-diaza-7,10,13,16-tetraoxacyclooctadecane (124213-29-2)

Guidance literature:

With tert-butyl alcohol; In 1,4-dioxane; for 21h; 1) add., 2h, 60 deg C, 2) reflux, 16 h;

upstream raw materials:

3,6-dioxa-4-<(allyloxy)methyl>-1,8-octanediol

p-toluenesulfonyl chloride

Downstream raw materials:

11-Allyloxymethyl-1,4-dibenzyl-1,4-diaza-7,10,13,16-tetraoxacyclooctadecane

5-<(allyloxy)methyl>-1,10-dibenzyl-4,7,13,16-tetraoxa-1,10-diazacyclooctadecane