Methyl 2-bromo-3,5-dinitrobenzoate

Base Information

Chemical Name:Methyl 2-bromo-3,5-dinitrobenzoate
CAS No.:36749-41-4
Molecular Formula:C8H5BrN2O6
Molecular Weight:305.041
Hs Code.:2916399090
NSC Number:159525
DSSTox Substance ID:DTXSID60303645
Wikidata:Q82049028
Mol file:36749-41-4.mol

Synonyms:methyl 2-bromo-3,5-dinitrobenzoate;36749-41-4;2-Bromo-3,5-dinitro-benzoic acid methyl ester;NSC159525;SCHEMBL13987139;DTXSID60303645;XSJXJYYYTKHXQW-UHFFFAOYSA-N;methyl2-bromo-3,5-dinitrobenzoate;AKOS011218881;NSC-159525;CS-0361760;2-bromo-3,5-dinitrobenzoic acid methyl ester

Suppliers and Price of Methyl 2-bromo-3,5-dinitrobenzoate

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

Apolloscientific
Methyl2-bromo-3,5-dinitrobenzoate 95%
5g
$ 1284.00

Total 2 raw suppliers

Chemical Property of Methyl 2-bromo-3,5-dinitrobenzoate

Chemical Property:

Vapor Pressure:2.22E-05mmHg at 25°C
Melting Point:106-108 °C
Boiling Point:360.5°Cat760mmHg
Flash Point:171.8°C
PSA：117.94000
Density:1.824g/cm³
LogP:3.09850
XLogP3:2.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:303.93310
Heavy Atom Count:17
Complexity:338

Purity/Quality:: Methyl2-bromo-3,5-dinitrobenzoate 95% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)C1=C(C(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-])Br

Technology Process of Methyl 2-bromo-3,5-dinitrobenzoate

There total 3 articles about Methyl 2-bromo-3,5-dinitrobenzoate 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: 65.0%

: 6942-36-5
methyl 2-bromo-5-nitrobenzoate

: 36749-41-4
2-bromo-3,5-dinitro-benzoic acid methyl ester

Guidance literature:: With sulfuric acid; nitric acid; at 40 ℃; for 60h;

Reference yield:

: 573-54-6
2-bromo-3-nitro-benzoic acid

: 36749-41-4
2-bromo-3,5-dinitro-benzoic acid methyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: concentrated sulfuric acid; fuming nitric acid

2: hydrogen chloride

With hydrogenchloride; sulfuric acid; nitric acid;
DOI:10.1021/ja01273a039