Methyl 5-methoxy-4-((1-methylpiperidin-4-yl)methoxy)-2-nitrobenzoate

Base Information

Chemical Name:Methyl 5-methoxy-4-((1-methylpiperidin-4-yl)methoxy)-2-nitrobenzoate
CAS No.:906565-53-5
Molecular Formula:C16H22N2O6
Molecular Weight:338.36
Hs Code.:
DSSTox Substance ID:DTXSID501132100

Synonyms:906565-53-5;SCHEMBL21473658;DTXSID501132100;Methyl 5-methoxy-4-((1-methylpiperidin-4-yl)methoxy)-2-nitrobenzoate;Methyl 4-((1-Methylpiperidin-4-yl)Methoxy)-5-Methoxy-2-nitrobenzoate;Benzoic acid, 5-methoxy-4-[(1-methyl-4-piperidinyl)methoxy]-2-nitro-, methyl ester

Suppliers and Price of Methyl 5-methoxy-4-((1-methylpiperidin-4-yl)methoxy)-2-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 5-methoxy-4-((1-methylpiperidin-4-yl)methoxy)-2-nitrobenzoate

Chemical Property:

XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:338.14778643
Heavy Atom Count:24
Complexity:433

Purity/Quality:: 95%-98% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1CCC(CC1)COC2=C(C=C(C(=C2)[N+](=O)[O-])C(=O)OC)OC

Technology Process of Methyl 5-methoxy-4-((1-methylpiperidin-4-yl)methoxy)-2-nitrobenzoate

There total 6 articles about Methyl 5-methoxy-4-((1-methylpiperidin-4-yl)methoxy)-2-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: 78.0%

: 635678-09-0
methyl 3-methoxy-4-(1-methylpiperidin-4-ylmethoxy)benzoate

: 906565-53-5
methyl 5-methoxy-4-(1-methylpiperidin-4-ylmethoxy)-2-nitrobenzoate

Guidance literature:: With nitric acid; trifluoroacetic acid; In dichloromethane; at 25 ℃;
DOI:10.1021/acsmedchemlett.8b00564

Reference yield:

: 3943-74-6
4-hydroxy-3-methoxybenzoic acid methyl ester

: 906565-53-5
methyl 5-methoxy-4-(1-methylpiperidin-4-ylmethoxy)-2-nitrobenzoate

Guidance literature:: Multi-step reaction with 4 steps

1: 92 percent / triphenylphosphine; diethyl azodicarboxylate / CH₂Cl₂; toluene / 1 h / 20 °C

2: HCl / dioxane / 1 h / 20 °C

3: 80 percent / formic acid / H₂O / 95 °C

4: nitric acid; trifluoroacetic acid / CH₂Cl₂ / 20 °C

With hydrogenchloride; formic acid; nitric acid; triphenylphosphine; trifluoroacetic acid; diethylazodicarboxylate; In 1,4-dioxane; dichloromethane; water; toluene;
DOI:10.1002/jlcr.998

Reference yield:

: 906565-52-4
methyl 3-methoxy-4-(1-tert-butyloxycarbonylpiperidin-4-ylmethoxy)benzoate

: 906565-53-5
methyl 5-methoxy-4-(1-methylpiperidin-4-ylmethoxy)-2-nitrobenzoate

Guidance literature:: Multi-step reaction with 3 steps

1: HCl / dioxane / 1 h / 20 °C

2: 80 percent / formic acid / H₂O / 95 °C

3: nitric acid; trifluoroacetic acid / CH₂Cl₂ / 20 °C

With hydrogenchloride; formic acid; nitric acid; trifluoroacetic acid; In 1,4-dioxane; dichloromethane; water;
DOI:10.1002/jlcr.998