2-Methoxy-3,4-dimethyl-5-nitrophenol

Base Information

• Chemical Name: 2-Methoxy-3,4-dimethyl-5-nitrophenol
• CAS No.: 118538-99-1
• Molecular Formula: C9H11NO4
• Molecular Weight: 197.191
• DSSTox Substance ID: DTXSID70558785
• Wikidata: Q82441203
• Mol file: 118538-99-1.mol

Synonyms:2-Methoxy-3,4-dimethyl-5-nitrophenol;118538-99-1;DTXSID70558785

Chemical Property of 2-Methoxy-3,4-dimethyl-5-nitrophenol

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 197.06880783
• Heavy Atom Count: 14
• Complexity: 215

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=C(C=C1[N+](=O)[O-])O)OC)C

Technology Process of 2-Methoxy-3,4-dimethyl-5-nitrophenol

There total 2 articles about 2-Methoxy-3,4-dimethyl-5-nitrophenol 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: 99.0%

2-methoxy-3,4-dimethyl-5-nitrophenyl acetate (147623-19-6) → 2-methoxy-3,4-dimethyl-5-nitrophenol (118538-99-1)

Guidance literature:

With potassium hydroxide; In ethanol; water; for 16h; Ambient temperature;

DOI:10.1002/hlca.19930760709

Reference yield:

acetic acid 2-methoxy-3,4-dimethylphenyl ester (118538-98-0) → 2-methoxy-3,4-dimethyl-5-nitrophenol (118538-99-1)

Guidance literature:

With potassium hydroxide; nitric acid; tin(IV) chloride; Multistep reaction; 1.) CH₂Cl₂; 2.) EtOH, 25 deg C;

Reference yield: 91.0%

diazomethane (186581-53-3,908094-01-9,334-88-3) + 2-methoxy-3,4-dimethyl-5-nitrophenol (118538-99-1) → 1,2-dimethoxy-3,4-dimethyl-5-nitrobenzene (153709-76-3)

Guidance literature:

In diethyl ether; for 3h;

DOI:10.1002/hlca.19930760709

upstream raw materials:

acetic acid 2-methoxy-3,4-dimethylphenyl ester

2-methoxy-3,4-dimethyl-5-nitrophenyl acetate

Downstream raw materials:

4,5-dimethoxy-2,3-dimethylaniline

1,2-dimethoxy-3,4-dimethyl-5-nitrobenzene

2-iodo-6-methoxy-4,5-dimethyl-3-nitrophenol

carbazomycin B

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