2,5-Dimethoxy-3,4-dimethylbenzenemethanol acetate

Base Information

• Chemical Name: 2,5-Dimethoxy-3,4-dimethylbenzenemethanol acetate
• CAS No.: 40870-62-0
• Molecular Formula: C₁₃H₁₈O₄
• Molecular Weight: 238.284
• Hs Code.: 2915390090
• DSSTox Substance ID: DTXSID30961276
• Wikidata: Q82942661
• Mol file: 40870-62-0.mol

Synonyms:2,5-Dimethoxy-3,4-dimethylbenzenemethanol acetate;40870-62-0;(2,5-dimethoxy-3,4-dimethylphenyl)methyl acetate;SCHEMBL9817705;Benzenemethanol, 2,5-dimethoxy-3,4-dimethyl-, acetate;DTXSID30961276;CCELRWHYVSHVSI-UHFFFAOYSA-N;5-acetoxymethyl-1,4-dimethoxy-2,3-dimethylbenzene

Chemical Property of 2,5-Dimethoxy-3,4-dimethylbenzenemethanol acetate

Chemical Property:

• Vapor Pressure: 0.000235mmHg at 25°C
• Boiling Point: 325.1°Cat760mmHg
• Flash Point: 140.2°C
• PSA: 44.76000
• Density: 1.069g/cm³
• LogP: 2.38370
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 238.12050905
• Heavy Atom Count: 17
• Complexity: 254

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=C(C(=C1C)OC)COC(=O)C)OC

Technology Process of 2,5-Dimethoxy-3,4-dimethylbenzenemethanol acetate

There total 1 articles about 2,5-Dimethoxy-3,4-dimethylbenzenemethanol acetate 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:

1-chloromethyl-2,5-dimethoxy-3,4-dimethyl-benzene (40870-58-4) + sodium acetate (127-09-3) → Acetic acid 2,5-dimethoxy-3,4-dimethyl-benzyl ester (40870-62-0)

Guidance literature:

With acetic acid;

DOI:10.1021/jm00282a011

Reference yield:

Acetic acid 2,5-dimethoxy-3,4-dimethyl-benzyl ester (40870-62-0) → 2-acetoxymethyl-5,6-dimethyl-1,4-benzoquinone (40870-69-7)

Guidance literature:

With silver(II) oxide; nitric acid;

DOI:10.1021/jm00282a011

upstream raw materials:

1-chloromethyl-2,5-dimethoxy-3,4-dimethyl-benzene

sodium acetate

Downstream raw materials:

2-acetoxymethyl-5,6-dimethyl-1,4-benzoquinone

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