4-Methoxy-3-nitrophenol

Base Information

• Chemical Name: 4-Methoxy-3-nitrophenol
• CAS No.: 15174-02-4
• Molecular Formula: C7H7NO4
• Molecular Weight: 169.137
• Hs Code.: 2909500000
• European Community (EC) Number: 813-013-9
• DSSTox Substance ID: DTXSID60566091
• Nikkaji Number: J801.855C
• Wikidata: Q72517291
• Mol file: 15174-02-4.mol

Synonyms:4-METHOXY-3-NITROPHENOL;15174-02-4;4-Hydroxy-2-nitroanisole;4-HYDROXY-2-NITRO-ANISOLE;MFCD00031284;PHENOL, 4-METHOXY-3-NITRO-;Phenol,4-methoxy-3-nitro-;SCHEMBL375443;DTXSID60566091;AADXAMFLYDYIFS-UHFFFAOYSA-N;AMY31151;AKOS006344260;AS-17903;SY023316;CS-0061910;EN300-169863;A846562;Z1201617635

Chemical Property of 4-Methoxy-3-nitrophenol

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.583
• Boiling Point: 340.51 °C at 760 mmHg
• PKA: 8.67±0.10(Predicted)
• Flash Point: 159.735 °C
• PSA: 75.28000
• Density: 1.367 g/cm³
• LogP: 1.83220
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 169.03750770
• Heavy Atom Count: 12
• Complexity: 167

Purity/Quality:

97% ^*data from raw suppliers

4-Methoxy-3-nitrophenol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1)O)[N+](=O)[O-]

Technology Process of 4-Methoxy-3-nitrophenol

There total 12 articles about 4-Methoxy-3-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: 100.0%

4-methoxy-3-nitrophenyl acetate (39653-87-7) → 4-hydroxy-2-nitroanisole (15174-02-4)

Guidance literature:

With sodium hydroxide; water; In ethanol; at 0 - 20 ℃; for 2h;

Reference yield: 18.0%

N-α-acetyllysine amide (19789-60-7) + 4-fluoro-1-methoxy-2-nitrobenzene (445-83-0) → N-acetyl-N'-(4-methoxy-3-nitrophenyl)lysinamide + 4-hydroxy-2-nitroanisole (15174-02-4)

Guidance literature:

In sodium hydrogencarbonate; acetonitrile; for 10h; Irradiation;

DOI:10.1562/2006-02-28-RA-824

Reference yield: 14.0%

4-fluoro-1-methoxy-2-nitrobenzene (445-83-0) → 4-hydroxy-2-nitroanisole (15174-02-4)

Guidance literature:

With N-acetyltyrosinamide; In sodium hydrogencarbonate; acetonitrile; Irradiation;

DOI:10.1562/2006-02-28-RA-824

upstream raw materials:

4-methoxy-3-nitrophenyl acetate

p-tert-butoxyanisole

p-Isopropoxyphenyl methyl ether

nitric acid

Downstream raw materials:

5-(2-(diethylamino)ethoxy)-2-methoxybenzamine

N,N-diethyl-2-(4-methoxy-3-nitrophenoxy)ethanamine

(2S)-2-({[4-(methyloxy)-3-nitrophenyl]oxy}methyl)oxirane