Methyl 4-pyridinylmethoxybenzoate

Base Information

• Chemical Name: Methyl 4-pyridinylmethoxybenzoate
• CAS No.: 50596-37-7
• Molecular Formula: C₁₄H₁₃NO₃
• Molecular Weight: 243.262
• DSSTox Substance ID: DTXSID401222150
• Mol file: 50596-37-7.mol

Synonyms:SCHEMBL1732629;methyl 4-pyridinylmethoxybenzoate;XFURDHATDHRUMP-UHFFFAOYSA-N;DTXSID401222150;AKOS008967030;SR-01000048898;4-(Pyridin-2-ylmethoxy)-benzoic Acid Methyl Ester;SR-01000048898-1;Benzoic acid, 4-(2-pyridinylmethoxy)-, methyl ester;Z56957536;50596-37-7

Chemical Property of Methyl 4-pyridinylmethoxybenzoate

Chemical Property:

• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 243.08954328
• Heavy Atom Count: 18
• Complexity: 262

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC(=O)C1=CC=C(C=C1)OCC2=CC=CC=N2

Technology Process of Methyl 4-pyridinylmethoxybenzoate

There total 3 articles about Methyl 4-pyridinylmethoxybenzoate 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: 94.0%

2-(bromomethyl)pyridine hydrobromide (31106-82-8) + methyl 4-hydroxylbenzoate (99-76-3,156291-94-0) → methyl 4-(pyridin-2-ylmethoxy)benzoate (50596-37-7)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 60 ℃; for 2.5h;

Reference yield:

2-Hydroxymethylpyridine (586-98-1) + methyl 4-hydroxylbenzoate (99-76-3,156291-94-0) → methyl 4-(pyridin-2-ylmethoxy)benzoate (50596-37-7)

Guidance literature:

With di-isopropyl azodicarboxylate; triphenylphosphine; In tetrahydrofuran; at 20 ℃; for 0.333333h;

Reference yield:

→ methyl 4-(pyridin-2-ylmethoxy)benzoate (50596-37-7)

Guidance literature:

upstream raw materials:

2-Hydroxymethylpyridine

methyl 4-hydroxylbenzoate

2-(bromomethyl)pyridine hydrobromide

Downstream raw materials:

(4-(pyridin-2-ylmethoxy)-phenyl)-methanol

4-(pyridin-2-ylmethoxy)benzoic acid