Methyl 2-(acetyloxy)-4,6-dimethyl-3-nitrobenzoate

Base Information

Chemical Name:Methyl 2-(acetyloxy)-4,6-dimethyl-3-nitrobenzoate
CAS No.:89586-10-7
Molecular Formula:C12H13NO6
Molecular Weight:267.23500
Hs Code.:
DSSTox Substance ID:DTXSID60519047
Wikidata:Q82381971

Synonyms:89586-10-7;Methyl 2-(acetyloxy)-4,6-dimethyl-3-nitrobenzoate;DTXSID60519047

Suppliers and Price of Methyl 2-(acetyloxy)-4,6-dimethyl-3-nitrobenzoate

Supply Marketing:

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

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Chemical Property of Methyl 2-(acetyloxy)-4,6-dimethyl-3-nitrobenzoate

Chemical Property:

PSA：98.42000
LogP:2.44670
XLogP3:2.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:267.07428713
Heavy Atom Count:19
Complexity:377

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=CC(=C(C(=C1C(=O)OC)OC(=O)C)[N+](=O)[O-])C

Technology Process of Methyl 2-(acetyloxy)-4,6-dimethyl-3-nitrobenzoate

There total 1 articles about Methyl 2-(acetyloxy)-4,6-dimethyl-3-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: 66.0%

: 108-24-7
acetic anhydride

: 87730-81-2
methyl 4,6-dimethyl-3-nitro-salicylate

: 89586-10-7
methyl 2-acetoxy-4,6-dimethyl-3-nitrobenzoate

Guidance literature:: With pyridine; for 24h;
DOI:10.1002/hlca.19830660821

Reference yield: 89.0%

: 89586-10-7
methyl 2-acetoxy-4,6-dimethyl-3-nitrobenzoate

: 87730-81-2
methyl 4,6-dimethyl-3-nitro-salicylate

Guidance literature:: With methanesulfonic acid; In methanol; for 15h; Heating;
DOI:10.1002/hlca.19830660821

Reference yield:

: 89586-10-7
methyl 2-acetoxy-4,6-dimethyl-3-nitrobenzoate

: 5345-09-5
3,5-dimethyl-2-nitrophenol

Guidance literature:: Multi-step reaction with 2 steps

1: 89 percent / CH₃SO₃H / methanol / 15 h / Heating

2: 1.) 10 percent NaOH / 1.) water, 1 h, 80 deg C; 2.) quinoline, 15 min, 200-210 deg C;

With sodium hydroxide; methanesulfonic acid; In methanol;
DOI:10.1002/hlca.19830660821