5-Chloro-2-fluorobenzamide

Base Information

• Chemical Name: 5-Chloro-2-fluorobenzamide
• CAS No.: 261762-57-6
• Molecular Formula: C7H5 Cl F N O
• Molecular Weight: 173.574
• Hs Code.: 2924299090
• DSSTox Substance ID: DTXSID70378581
• Wikidata: Q82168064
• Mol file: 261762-57-6.mol

Synonyms:5-chloro-2-fluorobenzamide;261762-57-6;MFCD01631435;2-Fluoro-5-chlorobenzamide;SCHEMBL910922;DTXSID70378581;VTSILFLCXIRODM-UHFFFAOYSA-N;5-Chloro-2-fluorobenzamide,97+%;STL560138;AKOS007930606;PS-8644;CS-0212071;FT-0693055;H10549;EN300-6986620;A818260;J-517301;Z116821726

Chemical Property of 5-Chloro-2-fluorobenzamide

Chemical Property:

• Melting Point: 134-138℃
• Boiling Point: 230.1°Cat760mmHg
• PKA: 14.68±0.50(Predicted)
• Flash Point: 92.9°C
• PSA: 43.09000
• Density: 1.396g/cm³
• LogP: 2.27830
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 173.0043696
• Heavy Atom Count: 11
• Complexity: 165

Purity/Quality:

97% ^*data from raw suppliers

5-Chloro-2-fluorobenzamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1Cl)C(=O)N)F

Technology Process of 5-Chloro-2-fluorobenzamide

There total 1 articles about 5-Chloro-2-fluorobenzamide 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: 91.0%

5-chloro-2-fluoro-benzoyl chloride (394-29-6) → 5-chloro-2-fluorobenzamide (261762-57-6)

Guidance literature:

With ammonia; In dichloromethane; water; for 0.5h;

Reference yield: 76.1%

5-chloro-2-fluorobenzamide (261762-57-6) + bis(trichloromethyl) carbonate (32315-10-9) + C14H9F4N3O3 → C21H13ClF5N3O2

Guidance literature:

5-chloro-2-fluorobenzamide; bis(trichloromethyl) carbonate; With triethylamine; In dichloromethane; at 20 ℃; for 0.333333h;

C₁₄H₉F₄N₃O₃; In dichloromethane; at 20 ℃; for 0.5h;

Reference yield: 60.0%

5-chloro-2-fluorobenzamide (261762-57-6) + dimethyl sulfoxide (67-68-5,8070-53-9) + Eudesmic acid (118-41-2) → 2-(5-chloro-2-fluorobenzoyl)-4,5,6-trimethoxyisoindolin-1-one

Guidance literature:

With ammonium persulfate; 2,3-dicyano-5,6-dichloro-p-benzoquinone; In 1,2-dichloro-ethane; at 130 ℃; for 24h; Inert atmosphere;

DOI:10.1002/chem.201600865

upstream raw materials:

5-chloro-2-fluoro-benzoyl chloride

Downstream raw materials:

2-Allylamino-5-chlorbenzamid

2-benzylsulphanyl-5-chloro-benzamide

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