N-(2-amino-4-fluorophenyl)-2-hydroxybenzamide

Base Information

• Chemical Name: N-(2-amino-4-fluorophenyl)-2-hydroxybenzamide
• CAS No.: 403599-68-8
• Molecular Formula: C13H11 F N2 O2
• Molecular Weight: 246.2370432
• DSSTox Substance ID: DTXSID80588311
• Wikidata: Q82480909
• Mol file: 403599-68-8.mol

Synonyms:403599-68-8;N-(2-amino-4-fluorophenyl)-2-hydroxybenzamide;DTXSID80588311;AKOS000132275

Chemical Property of N-(2-amino-4-fluorophenyl)-2-hydroxybenzamide

Chemical Property:

• PSA: 78.84000
• LogP: 3.33100
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 246.08045576
• Heavy Atom Count: 18
• Complexity: 301

Purity/Quality:

N-(2-AMINO-4-FLUOROPHENYL)-2-HYDROXY-BENZAMIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C(=O)NC2=C(C=C(C=C2)F)N)O

Technology Process of N-(2-amino-4-fluorophenyl)-2-hydroxybenzamide

There total 3 articles about N-(2-amino-4-fluorophenyl)-2-hydroxybenzamide 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: 67.0%

N-(4'-fluoro-2'-nitrophenyl)-2-hydroxybenzamide (37183-29-2) → N-(4-fluoro-2-aminophenyl)salicylamide (403599-68-8)

Guidance literature:

With hydrogen; palladium on activated charcoal; In acetic acid; at 20 ℃;

DOI:10.1016/S0014-827X(01)01146-6

Reference yield:

sodium O-acetylsalicylate (493-53-8) → N-(4-fluoro-2-aminophenyl)salicylamide (403599-68-8)

Guidance literature:

Multi-step reaction with 3 steps

1: SOCl₂ / 2.33 h / 0 - 20 °C

2: 95 percent / benzene / 16 h / Heating

3: 67 percent / H₂ / Pd/C / acetic acid / 20 °C

With thionyl chloride; hydrogen; palladium on activated charcoal; In acetic acid; benzene;

DOI:10.1016/S0014-827X(01)01146-6

Reference yield:

O-acetylsalicyloyl chloride (5538-51-2) → N-(4-fluoro-2-aminophenyl)salicylamide (403599-68-8)

Guidance literature:

Multi-step reaction with 2 steps

1: 95 percent / benzene / 16 h / Heating

2: 67 percent / H₂ / Pd/C / acetic acid / 20 °C

With hydrogen; palladium on activated charcoal; In acetic acid; benzene;

DOI:10.1016/S0014-827X(01)01146-6

upstream raw materials:

N-(4'-fluoro-2'-nitrophenyl)-2-hydroxybenzamide

sodium O-acetylsalicylate

O-acetylsalicyloyl chloride