2-Chloro-4,6-dinitrobenzoic acid

Base Information

Chemical Name:2-Chloro-4,6-dinitrobenzoic acid
CAS No.:95192-61-3
Molecular Formula:C₇H₃ClN₂O₆
Molecular Weight:246.564
Hs Code.:
DSSTox Substance ID:DTXSID90376605
Wikidata:Q82165495
Mol file:95192-61-3.mol

Synonyms:2-chloro-4,6-dinitrobenzoic acid;95192-61-3;SCHEMBL9737315;DTXSID90376605;FT-0749190

Suppliers and Price of 2-Chloro-4,6-dinitrobenzoic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

American Custom Chemicals Corporation
2-CHLORO-4,6-DINITROBENZOIC ACID 95.00%
5MG
$ 498.77

Total 8 raw suppliers

Chemical Property of 2-Chloro-4,6-dinitrobenzoic acid

Chemical Property:

Vapor Pressure:4.03E-07mmHg at 25°C
Melting Point:199-200 °C
Refractive Index:1.666
Boiling Point:400.1°Cat760mmHg
PKA:0.76±0.34(Predicted)
Flash Point:195.8°C
PSA：128.94000
Density:1.791g/cm³
LogP:2.90100
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:245.9679635
Heavy Atom Count:16
Complexity:324

Purity/Quality:

98%Min ^*data from raw suppliers

2-CHLORO-4,6-DINITROBENZOIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 2-Chloro-4,6-dinitrobenzoic acid

There total 2 articles about 2-Chloro-4,6-dinitrobenzoic acid 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:

: 96-90-2
1-chloro-2-methyl-3,5-dinitrobenzene

: 95192-61-3
2-chloro-4,6-dinitrobenzoic acid

Guidance literature:: With sodium dichromate; sulfuric acid;
DOI:10.1021/jo00207a027

Reference yield:

: 121-14-2
2,4-dinitrotoluene

: 95192-61-3
2-chloro-4,6-dinitrobenzoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: Ag₂SO₄, aq. H₂SO₄, Cl₂(gas) / 40 h / 85 °C

2: sodium dichromate, H₂SO₄

With sodium dichromate; sulfuric acid; chlorine; silver sulfate;
DOI:10.1021/jo00207a027

Reference yield:

: 95192-61-3
2-chloro-4,6-dinitrobenzoic acid

: 618-86-0
1-chloro-3,5-dinitrobenzene

Guidance literature:: In water; at 125.6 ℃; Rate constant; Thermodynamic data; Kinetics; ΔH(excit.), ΔS(excit.); other temp.;
DOI:10.1021/jo00207a027