2-(Chloromethyl)-4-methoxypyridine

Base Information

• Chemical Name: 2-(Chloromethyl)-4-methoxypyridine
• CAS No.: 99651-28-2
• Molecular Formula: C7H8ClNO
• Molecular Weight: 157.6
• Hs Code.: 2933399090
• European Community (EC) Number: 848-603-5
• DSSTox Substance ID: DTXSID40440643
• Nikkaji Number: J1.350.468G
• Wikidata: Q82257005
• Mol file: 99651-28-2.mol

Synonyms:2-(Chloromethyl)-4-methoxypyridine;99651-28-2;4-methoxy-2-picolyl chloride;2-CHLOROMETHYL-4-METHOXY-PYRIDINE;2-Chloromethyl-4-methoxypyridine;2-(chloromethyl)-4-methoxy-pyridine;CHEMPACIFIC38147;SCHEMBL3862419;2-chloromethyl-4-methoxypyridine;DTXSID40440643;UODFFWGYSJVFCZ-UHFFFAOYSA-N;AMY10914;MFCD07774101;AKOS005068012;AB42302;AC-22782;FT-0729177;EN300-304838;2-(Chloromethyl)-4-methoxypyridine x1.02hcl 0.19h2o

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

Chemical Property:

• Vapor Pressure: 0.062mmHg at 25°C
• Boiling Point: 239.463oC at 760 mmHg
• PKA: 5.02±0.20(Predicted)
• Flash Point: 98.624oC
• PSA: 22.12000
• Density: 1.173g/cm3
• LogP: 1.82900
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 157.0294416
• Heavy Atom Count: 10
• Complexity: 99.6

Purity/Quality:

98%Min ^*data from raw suppliers

2-(Chloromethyl)-4-methoxypyridine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

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

There total 10 articles about 2-(Chloromethyl)-4-methoxypyridine 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 (99651-28-2)

Guidance literature:

With thionyl chloride; In dichloromethane; at 0 - 45 ℃; for 3.5h;

DOI:10.1246/bcsj.20150037

Reference yield:

2-methyl-4-nitropyridine N-oxide (5470-66-6) → 2-chloromethyl-4-methoxypyridine (99651-28-2)

Guidance literature:

Multi-step reaction with 3 steps

1: acetic anhydride

2: thionyl chloride

With thionyl chloride; acetic anhydride;

DOI:10.1021/ja0276366

Reference yield:

4-methoxy-2-methylpyridine 1-oxide (6890-60-4) → 2-chloromethyl-4-methoxypyridine (99651-28-2)

Guidance literature:

Multi-step reaction with 2 steps

1: acetic anhydride

2: thionyl chloride

With thionyl chloride; acetic anhydride;

DOI:10.1021/ja0276366

upstream raw materials:

4-methoxy-2-(hydroxymethyl)pyridine

2-methylpyridine N-oxide

4-methoxy-2-methylpyridine 1-oxide

2-methyl-4-nitropyridine N-oxide

Downstream raw materials:

6-(4-Methoxy-phenyl)-2-(4-methoxy-pyridin-2-ylmethanesulfinyl)-3H-thieno[3,4-d]imidazole

2-(4-Methoxy-pyridin-2-ylmethanesulfinyl)-6-phenyl-3H-thieno[3,4-d]imidazole

6-(4-Methoxy-phenyl)-2-(4-methoxy-pyridin-2-ylmethylsulfanyl)-3H-thieno[3,4-d]imidazole

2-(4-Methoxy-pyridin-2-ylmethylsulfanyl)-6-phenyl-3H-thieno[3,4-d]imidazole

Refernces

• 1、 -. "DINUCLEATING LIGAND OR DINUCLEAR METAL COMPLEX". Paragraph 0076; 0080-0081. . Retrieved 2021/03/19.
• 2、 Henson, Mark J.,Vance, Michael A.,Zhang, Christiana Xin,Hong-Chang, Liang,Karlin, Kenneth D.,Solomon, Edward I.. "Resonance Raman investigation of equatorial ligand donor effects on the CU2O22+ core in end-on and side-on μ-peroxo-dicopper(II) and bis-μ-oxo-dicopper(III) complexes". . p. 5186 - 5192. Retrieved 2007/10/03.