2-Chloro-5-nitrobenzoyl chloride

Base Information

• Chemical Name: 2-Chloro-5-nitrobenzoyl chloride
• CAS No.: 25784-91-2
• Molecular Formula: C7H3Cl2NO3
• Molecular Weight: 220.012
• Hs Code.: 2916399090
• European Community (EC) Number: 247-262-4
• DSSTox Substance ID: DTXSID9067148
• Nikkaji Number: J150.846F
• Wikidata: Q72455802
• Mol file: 25784-91-2.mol

Synonyms:2-Chloro-5-nitrobenzoyl chloride;25784-91-2;2-Chloro-5-nitrobenzoylchloride;Benzoyl chloride, 2-chloro-5-nitro-;2-chloro-5-nitro-benzoyl chloride;EINECS 247-262-4;MFCD00059180;2-chloro-5-nitrobenzoic acid chloride;SCHEMBL398463;2-chloro-5nitrobenzoyl chloride;DTXSID9067148;2-Chloro-5-Nitro-Benzoylchlorid;2-chloro-5-nitro-benzoic chloride;AMY28118;2-chloranyl-5-nitro-benzoyl chloride;AKOS003634134;GS-6063;AC-26027;FT-0611835;2-chloro-5-nitrobenzoyl chloride, AldrichCPR;F11412;EN300-1459117;A818518;A928416;W-107218

Chemical Property of 2-Chloro-5-nitrobenzoyl chloride

Chemical Property:

• Vapor Pressure: 0.000705mmHg at 25°C
• Melting Point: 58-60°C
• Refractive Index: 1.602
• Boiling Point: 307.9 °C at 760 mmHg
• Flash Point: 140 °C
• PSA: 62.89000
• Density: 1.575g/cm³
• LogP: 3.15040
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Sensitive.: Moisture Sensitive
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 218.9489983
• Heavy Atom Count: 13
• Complexity: 228

Purity/Quality:

98% ^*data from raw suppliers

2-Chloro-5-nitrobenzoyl Chloride >98.0%(GC)(T) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C,Xi
• Hazard Codes: C,Xi
• Statements: 34-41
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1[N+](=O)[O-])C(=O)Cl)Cl

Technology Process of 2-Chloro-5-nitrobenzoyl chloride

There total 9 articles about 2-Chloro-5-nitrobenzoyl 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: 100.0%

2-chloro-5-nitrobenzoic acid (2516-96-3) → 2-chloro-5-nitrobenzoylchloride (25784-91-2)

Guidance literature:

With thionyl chloride;

Reference yield:

oxalyl dichloride (79-37-8) + 2-chloro-5-nitrobenzoic acid (2516-96-3) → 2-chloro-5-nitrobenzoylchloride (25784-91-2)

Guidance literature:

In dichloromethane; N,N-dimethyl-formamide;

Reference yield:

ortho-chlorobenzoic acid (118-91-2) → 2-chloro-5-nitrobenzoylchloride (25784-91-2)

Guidance literature:

Multi-step reaction with 2 steps

1: nitric acid

2: PCl₅

With phosphorus pentachloride; nitric acid;

upstream raw materials:

2-chloro-5-nitrobenzoic acid

2-chloro-5-nitro-benzamide

2-Chlorobenzonitrile

4-chloro-3-cyanonitrobenzene

Downstream raw materials:

2-chloro-5-nitro-benzoic acid methyl ester

2-chloro-5-nitro-benzoic acid-(2-dimethylamino-ethyl ester); hydrochloride

2-chloro-5-nitro-benzamide

2'-chloro-5'-nitroacetophenone