Methyl 2-(acetyloxy)-5-nitrobenzoate

Base Information

Chemical Name:Methyl 2-(acetyloxy)-5-nitrobenzoate
CAS No.:61294-22-2
Molecular Formula:C10H9NO6
Molecular Weight:239.185
Hs Code.:
DSSTox Substance ID:DTXSID80543824
Wikidata:Q82420787

Synonyms:61294-22-2;Methyl 2-(acetyloxy)-5-nitrobenzoate;SCHEMBL10605482;DTXSID80543824

Suppliers and Price of Methyl 2-(acetyloxy)-5-nitrobenzoate

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

Total 1 raw suppliers

Chemical Property of Methyl 2-(acetyloxy)-5-nitrobenzoate

Chemical Property:

XLogP3:1.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:239.04298701
Heavy Atom Count:17
Complexity:323

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)OC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OC

Technology Process of Methyl 2-(acetyloxy)-5-nitrobenzoate

There total 4 articles about Methyl 2-(acetyloxy)-5-nitrobenzoate 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: 91.0%

: 17302-46-4
methyl 2-hydroxy-5-nitrobenzoate

: 75-36-5
acetyl chloride

: 61294-22-2
methyl 2-acetoxy-5-nitrobenzoate

Guidance literature:: With triethylamine; In tetrahydrofuran; at 0 ℃; for 2h; Inert atmosphere;
DOI:10.1016/j.ejmech.2018.01.077

Reference yield: 83.2%

: 17302-46-4
methyl 2-hydroxy-5-nitrobenzoate

: 108-24-7
acetic anhydride

: 61294-22-2
methyl 2-acetoxy-5-nitrobenzoate

Guidance literature:: With sulfuric acid; for 3h; Heating;
DOI:10.1002/(SICI)1521-4184(19999)332:9<321::AID-ARDP321>3.0.CO;2-A

Reference yield:

: 96-97-9
5-nitrosalicylic acid

: 61294-22-2
methyl 2-acetoxy-5-nitrobenzoate

Guidance literature:: Multi-step reaction with 2 steps

1: 57.86 percent / conc. H₂SO₄ / 9 h / Heating

2: 83.2 percent / conc. H₂SO₄ / 3 h / Heating

With sulfuric acid; 1: Esterification / 2: Acetylation;
DOI:10.1002/(SICI)1521-4184(19999)332:9<321::AID-ARDP321>3.0.CO;2-A