2-Acetamido-5-fluoro-4-nitrobenzoic acid

Base Information

• Chemical Name: 2-Acetamido-5-fluoro-4-nitrobenzoic acid
• CAS No.: 273401-28-8
• Molecular Formula: C9H7FN2O5
• Molecular Weight: 242.1606832
• European Community (EC) Number: 961-858-8
• DSSTox Substance ID: DTXSID30594902
• Wikidata: Q82489824
• Mol file: 273401-28-8.mol

Synonyms:2-Acetamido-5-fluoro-4-nitrobenzoic acid;273401-28-8;2-Acetamido-5-fluoro-4-nitrobenzoicacid;C9H7FN2O5;SCHEMBL5167381;DTXSID30594902;CNLJIEQUDKSTHL-UHFFFAOYSA-N;MFCD24038776;SY205242;DB-338048;2-acetylamino-5-fluoro-4-nitro-benzoic acid;CS-0215442;EN300-247622;Benzoic acid, 2-(acetylaMino)-5-fluoro-4-nitro-

Chemical Property of 2-Acetamido-5-fluoro-4-nitrobenzoic acid

Chemical Property:

• PSA: 115.71000
• LogP: 2.56320
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 242.03389949
• Heavy Atom Count: 17
• Complexity: 343

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

2-Acetamido-5-fluoro-4-nitrobenzoicacid 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=CC(=C(C=C1C(=O)O)F)[N+](=O)[O-]

Technology Process of 2-Acetamido-5-fluoro-4-nitrobenzoic acid

There total 1 articles about 2-Acetamido-5-fluoro-4-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: 19.0%

→ 2-acetylamino-5-fluoro-4-nitro-benzoic acid (273401-28-8)

Guidance literature:

Reference yield: 82.0%

2-acetylamino-5-fluoro-4-nitro-benzoic acid (273401-28-8) → 2-amino-5-fluoro-4-nitro-benzoic acid (174566-51-9)

Guidance literature:

With hydrogenchloride;

Downstream raw materials:

2-amino-5-fluoro-4-nitro-benzoic acid