4-Chloro-3,5-dinitrobenzamide

Base Information

• Chemical Name: 4-Chloro-3,5-dinitrobenzamide
• CAS No.: 20731-63-9
• Molecular Formula: C7H4 Cl N3 O5
• Molecular Weight: 245.579
• Hs Code.: 2924299090
• European Community (EC) Number: 243-998-5
• NSC Number: 76582
• DSSTox Substance ID: DTXSID70174803
• Nikkaji Number: J225.320H
• Mol file: 20731-63-9.mol

Synonyms:4-Chloro-3,5-dinitrobenzamide;20731-63-9;C7H4ClN3O5;3,5-DINITRO-4-CHLOROBENZAMIDE;Benzamide, 4-chloro-3,5-dinitro-;EINECS 243-998-5;4-CHLORO-3,5-DINITROBENZ-AMIDE;NSC76582;SCHEMBL6570802;C7-H4-Cl-N3-O5;DTXSID70174803;NSC 76582;NSC-76582;STK395738;AKOS005434470;CS-0360355;FT-0722093

Chemical Property of 4-Chloro-3,5-dinitrobenzamide

Chemical Property:

• Vapor Pressure: 0.000346mmHg at 25°C
• Boiling Point: 319.1°Cat760mmHg
• Flash Point: 146.8°C
• PSA: 134.73000
• Density: 1.708g/cm³
• LogP: 3.00200
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 244.9839479
• Heavy Atom Count: 16
• Complexity: 301

Purity/Quality:

98%,99%, ^*data from raw suppliers

4-Chloro-3,5-dinitrobenzamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

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

Technology Process of 4-Chloro-3,5-dinitrobenzamide

There total 4 articles about 4-Chloro-3,5-dinitrobenzamide 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:

3,5-dinitro-4-chlorobenzenecarboxylic acid chloride (42486-87-3) + ammonium hydroxide → 4-chloro-3,5-dinitrobenzamide (20731-63-9) + 4-amino-3,5-dinitrobenzamide (54321-79-8)

Guidance literature:

Reference yield:

3,5-dinitro-4-chlorobenzenecarboxylic acid chloride (42486-87-3) → 4-chloro-3,5-dinitrobenzamide (20731-63-9)

Guidance literature:

With ammonia;

Reference yield:

4-chloro-3,5-dinitrobenzoic acid (118-97-8) → 4-chloro-3,5-dinitrobenzamide (20731-63-9)

Guidance literature:

Multi-step reaction with 2 steps

1: benzene; PCl₅

2: concentrated ammonia

With phosphorus pentachloride; ammonia; benzene;

upstream raw materials:

3,5-dinitro-4-chlorobenzenecarboxylic acid chloride

4-chloro-3,5-dinitrobenzoic acid

Downstream raw materials:

3,5-dinitro-4-(1,2,3,4-tetrahydroisoquinolin-2-yl)benzamide

N-[5-Carbamoyl-2-chloro-3-(ethoxyoxalyl-amino)-phenyl]-oxalamic acid ethyl ester

N-[5-Carbamoyl-2-chloro-3-(oxalyl-amino)-phenyl]-oxalamic acid

6-(4-chloro-3,5-dinitro-phenyl)-3-phenyl-2-phenylimino-2,3-dihydro-[1,3,5]oxadiazin-4-one