Benzene, 1,2-bis(ethoxymethyl)-

Base Information

• Chemical Name: Benzene, 1,2-bis(ethoxymethyl)-
• CAS No.: 113245-36-6
• Molecular Formula: C12H18O2
• Molecular Weight: 194.274
• DSSTox Substance ID: DTXSID90473749
• Nikkaji Number: J1.516.338K
• Wikidata: Q82303356

Synonyms:Benzene, 1,2-bis(ethoxymethyl)-;113245-36-6;SCHEMBL648250;DTXSID90473749

Chemical Property of Benzene, 1,2-bis(ethoxymethyl)-

Chemical Property:

• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 194.130679813
• Heavy Atom Count: 14
• Complexity: 120

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOCC1=CC=CC=C1COCC

Technology Process of Benzene, 1,2-bis(ethoxymethyl)-

There total 3 articles about Benzene, 1,2-bis(ethoxymethyl)- 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: 90.0%

ethanol (64-17-5) + α,α'-dibromo-o-xylene (91-13-4) → α,α'-diethoxy-o-xylene (113245-36-6)

Guidance literature:

With iron(II) sulfate; at 75 ℃; for 12h;

DOI:10.1080/00397911003642674

Reference yield: 60.0%

α,α'-dibromo-o-xylene (91-13-4) → o-xylene (95-47-6) + 1,2-bis(2-methylphenyl)ethane (952-80-7) + α,α'-diethoxy-o-xylene (113245-36-6) + 1,2-bis(o-ethoxymethylphenyl)ethane

Guidance literature:

With sodium; In toluene; for 24h; Heating;

Reference yield:

→ α,α'-diethoxy-o-xylene (113245-36-6)

Guidance literature:

With potassium hydroxide;

upstream raw materials:

α,α'-dibromo-o-xylene

ethanol

Downstream raw materials:

2-ethoxymethyl-benzaldehyde

o-phthalic dicarboxaldehyde

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