4-Ethoxy-5-methoxy-2-nitrobenzoic acid

Base Information

• Chemical Name: 4-Ethoxy-5-methoxy-2-nitrobenzoic acid
• CAS No.: 103095-48-3
• Molecular Formula: C10H11 N O6
• Molecular Weight: 241.2
• Hs Code.: 2918990090
• DSSTox Substance ID: DTXSID40427853
• Wikidata: Q82240569
• Mol file: 103095-48-3.mol

Synonyms:4-ethoxy-5-methoxy-2-nitrobenzoic acid;103095-48-3;4-ETHOXY-5-METHOXY-2-NITROBENZOICACID;DTXSID40427853;AKOS008052501;CS-0234551;EN300-14299;J-515270;Z99599886

Chemical Property of 4-Ethoxy-5-methoxy-2-nitrobenzoic acid

Chemical Property:

• Vapor Pressure: 1.11E-07mmHg at 25°C
• Boiling Point: 416.5°Cat760mmHg
• Flash Point: 205.7°C
• PSA: 101.58000
• Density: g/cm³
• LogP: 2.22350
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 241.05863707
• Heavy Atom Count: 17
• Complexity: 289

Purity/Quality:

98%min ^*data from raw suppliers

4-Ethoxy-5-methoxy-2-nitrobenzoicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)O)OC

Technology Process of 4-Ethoxy-5-methoxy-2-nitrobenzoic acid

There total 5 articles about 4-Ethoxy-5-methoxy-2-nitrobenzoic acid 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:

4-ethoxy-3-methoxybenzoic acid (3535-30-6) → 4-ethoxy-5-methoxy-2-nitro-benzoic acid (103095-48-3)

Guidance literature:

With nitric acid;

DOI:10.1039/jr9590000172

Reference yield:

4-ethoxy-5-methoxy-2-nitro-toluene (103095-41-6) → 4-ethoxy-5-methoxy-2-nitro-benzoic acid (103095-48-3)

Guidance literature:

With potassium permanganate;

Reference yield:

4-ethoxy-3-methoxytoluene (33963-27-8) → 4-ethoxy-5-methoxy-2-nitro-benzoic acid (103095-48-3)

Guidance literature:

Multi-step reaction with 2 steps

1: acetic acid; concentrated aqueous HNO₃

2: KMnO₄

With potassium permanganate; nitric acid; acetic acid;

upstream raw materials:

4-ethoxy-3-methoxybenzoic acid

4-ethoxy-5-methoxy-2-nitro-toluene

4-ethoxy-3-methoxytoluene

4-ethoxy-3-methoxybenzaldehyde