2-(Chloromethyl)-4-methoxypyridine hydrochloride

Base Information

• Chemical Name: 2-(Chloromethyl)-4-methoxypyridine hydrochloride
• CAS No.: 62734-08-1
• Molecular Formula: C7H9Cl2NO
• Molecular Weight: 194.061
• Hs Code.: 2933399090
• European Community (EC) Number: 839-472-5
• DSSTox Substance ID: DTXSID80552532
• Mol file: 62734-08-1.mol

Synonyms:2-(chloromethyl)-4-methoxypyridine hydrochloride;62734-08-1;2-(chloromethyl)-4-methoxypyridine;hydrochloride;MFCD08234866;2-(CHLOROMETHYL)-4-METHOXYPYRIDINEHYDROCHLORIDE;2-(chloromethyl)-4-methoxypyridine,hydrochloride;2-chloromethyl-4-methoxypyridine hydrochloride;SCHEMBL242520;AMY6329;DTXSID80552532;PBDFBZPTRXMFBL-UHFFFAOYSA-N;4-methoxypicolyl chloride hydrochloride;AKOS016015077;MB05825;DS-14297;SY188471;CS-0029801;4-methoxy-2-chloromethylpyridine hydrochloride;EN300-70746;2-(CHLOROMETHYL)-4-METHOXYPYRIDINE HCL;2-(Chloromethyl)-4-methoxypyridine--hydrogen chloride (1/1)

Chemical Property of 2-(Chloromethyl)-4-methoxypyridine hydrochloride

Chemical Property:

• PSA: 22.12000
• LogP: 2.63100
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 193.0061193
• Heavy Atom Count: 11
• Complexity: 99.6

Purity/Quality:

99.3% ^*data from raw suppliers

2-(chloromethyl)-4-methoxypyridinehydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=NC=C1)CCl.Cl

Technology Process of 2-(Chloromethyl)-4-methoxypyridine hydrochloride

There total 6 articles about 2-(Chloromethyl)-4-methoxypyridine hydrochloride 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: 100.0%

4-methoxy-2-(hydroxymethyl)pyridine (16665-38-6) → 2-Chloromethyl-4-methoxypyridine hydrochloride (62734-08-1)

Guidance literature:

With thionyl chloride; In dichloromethane; for 2h;

DOI:10.1021/jm00025a008

Reference yield:

2-methyl-4-nitropyridine N-oxide (5470-66-6) → 2-Chloromethyl-4-methoxypyridine hydrochloride (62734-08-1)

Guidance literature:

Multi-step reaction with 4 steps

1: 100 percent / K₂CO₃ / 12 h / Heating

2: 4 h / 100 °C

3: 2 M NaOH / 1 h / 100 °C

4: 100 percent / SOCl₂ / CH₂Cl₂ / 2 h

With sodium hydroxide; thionyl chloride; potassium carbonate; In dichloromethane;

DOI:10.1021/jm00025a008

Reference yield:

4-methoxy-2-methylpyridine 1-oxide (6890-60-4) → 2-Chloromethyl-4-methoxypyridine hydrochloride (62734-08-1)

Guidance literature:

Multi-step reaction with 3 steps

1: 4 h / 100 °C

2: 2 M NaOH / 1 h / 100 °C

3: 100 percent / SOCl₂ / CH₂Cl₂ / 2 h

With sodium hydroxide; thionyl chloride; In dichloromethane;

DOI:10.1021/jm00025a008

upstream raw materials:

4-methoxy-2-(hydroxymethyl)pyridine

α-picoline

4-methoxy-2-methylpyridine 1-oxide

2-methyl-4-nitropyridine N-oxide

Downstream raw materials:

2-([{2-[(2,6-dichlorophenyl)imino]-1-imidazolidinyl}-oxy]methyl)-4-methoxypyridine

Refernces

• 1、 Kuhler,Fryklund,Bergman,Weilitz,Lee,Larsson. "Structure-activity relationship of omeprazole and analogues as Helicobacter pylori urease inhibitors". . p. 4906 - 4916. Retrieved 2007/10/03.
• 2、 -. "[1,3]-Dioxolo[4,5-f]benzimidazoles and [1,4]-dioxino[2,3-f]benzimidazoles". . . Retrieved 2008/06/13.