2,4-Dinitrobenzoyl chloride

Base Information

• Chemical Name: 2,4-Dinitrobenzoyl chloride
• CAS No.: 20195-22-6
• Molecular Formula: C7H3ClN2O5
• Molecular Weight: 230.564
• Hs Code.: 2916399090
• European Community (EC) Number: 243-578-1
• UNII: ZJ9Q2PGX6R
• DSSTox Substance ID: DTXSID40174032
• Nikkaji Number: J280.474C
• Wikidata: Q83044085
• Mol file: 20195-22-6.mol

Synonyms:2,4-Dinitrobenzoyl chloride;20195-22-6;Benzoyl chloride, 2,4-dinitro-;EINECS 243-578-1;ZJ9Q2PGX6R;SCHEMBL3126462;DTXSID40174032;MFCD01318511

Chemical Property of 2,4-Dinitrobenzoyl chloride

Chemical Property:

• Vapor Pressure: 3.93E-05mmHg at 25°C
• Boiling Point: 352.1°C at 760 mmHg
• Flash Point: 166.7°C
• PSA: 108.71000
• Density: 1.652g/cm³
• LogP: 2.92840
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 229.9730489
• Heavy Atom Count: 15
• Complexity: 297

Purity/Quality:

99% ^*data from raw suppliers

2,4-DinitrobenzoylChloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)Cl
• Uses: 2,4-Dinitrobenzoyl Chloride is a reagent for the synthesis of new benzoyl hydrazones, which exhibits antioxidant, anticholinesterase and anticancer activities.

Technology Process of 2,4-Dinitrobenzoyl chloride

There total 2 articles about 2,4-Dinitrobenzoyl chloride 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: 98.8%

2,4-dinitrobenzoic acid (610-30-0) → 2,4-dinitrobenzoyl chloride (20195-22-6)

Guidance literature:

With thionyl chloride; In 1,2-dichloro-ethane; for 2h; Heating;

Reference yield:

→ 2,4-dinitrobenzoyl chloride (20195-22-6)

Guidance literature:

Reference yield: 97.0%

2,4-dinitrobenzoyl chloride (20195-22-6) + morphine (57-27-2,143-70-4,6912-73-8,16206-77-2,27067-73-8,65165-99-3,70982-47-7) → C24H21N3O8

Guidance literature:

With potassium carbonate; In water; isopropyl alcohol; at -10 - 20 ℃; for 0.5h; Industrial scale;

upstream raw materials:

2,4-dinitrobenzoic acid

Downstream raw materials:

phosphoric acid-(β,β'-bis-palmitoyloxy-isopropyl ester)-[2-(2,4-dinitro-benzoylamino)-ethyl ester]

2-(2,4-dinitro-phenyl)-benzothiazole

2,4-dinitrobenzophenone

2,4-dinitrobenzoyl azide