2,4-Bis(methoxymethyl)-1,3,5-trimethylbenzene

Base Information

• Chemical Name: 2,4-Bis(methoxymethyl)-1,3,5-trimethylbenzene
• CAS No.: 133473-85-5
• Molecular Formula: C₁₃H₂₀O₂
• Molecular Weight: 208.301
• DSSTox Substance ID: DTXSID50395019
• Nikkaji Number: J397.097C
• Wikidata: Q82194787
• Mol file: 133473-85-5.mol

Synonyms:2,4-bis(methoxymethyl)-1,3,5-trimethylbenzene;133473-85-5;2,4-Bis(methoxymethyl)mesitylene;DTXSID50395019;AKOS005257579;2,4-BIS-METHOXYMETHYL-1,3,5-TRIMETHYL-BENZENE

Chemical Property of 2,4-Bis(methoxymethyl)-1,3,5-trimethylbenzene

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 208.146329876
• Heavy Atom Count: 15
• Complexity: 163

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC(=C(C(=C1COC)C)COC)C

Technology Process of 2,4-Bis(methoxymethyl)-1,3,5-trimethylbenzene

There total 3 articles about 2,4-Bis(methoxymethyl)-1,3,5-trimethylbenzene 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: 44.0%

methanol (67-56-1) + pentamethylbenzene, (700-12-9) → 2-(Methoxymethyl)-1,3,4,5-tetramethylbenzene (62608-81-5) + 2,4-bis-methoxymethyl-1,3,5-trimethyl-benzene (133473-85-5) + 3,6-Dimethoxy-1,2,3,4,6-pentamethylcyclohexa-1,4-diene (127451-64-3,127451-65-4)

Guidance literature:

With sodium methylate; at 25 - 30 ℃; for 2h; carbon-paste anode (50 mA/cm²), stainless steel cathode;

DOI:10.1021/jo00011a042

Reference yield:

2,4-bis(chloromethyl)mesitylene (1585-17-7) → 2,4-bis-methoxymethyl-1,3,5-trimethyl-benzene (133473-85-5)

Guidance literature:

With potassium hydroxide;

Reference yield:

1,3,5-trimethyl-benzene (108-67-8) → 2,4-bis-methoxymethyl-1,3,5-trimethyl-benzene (133473-85-5)

Guidance literature:

Multi-step reaction with 2 steps

1: aqueous HCl / 65 °C / Einleiten von HCl

2: methanol. KOH

With hydrogenchloride; potassium hydroxide;

upstream raw materials:

2,4-bis(chloromethyl)mesitylene

methanol

pentamethylbenzene,

1,3,5-trimethyl-benzene