2-CYANOMETHYL-3-NITRO-6-METHOXY PYRIDINE

Base Information

• Chemical Name: 2-CYANOMETHYL-3-NITRO-6-METHOXY PYRIDINE
• CAS No.: 111795-99-4
• Molecular Formula: C8H7 N3 O3
• Molecular Weight: 193.16
• Mol file: 111795-99-4.mol

Synonyms:(6-Methoxy-3-nitropyridin-2-yl)acetonitrile

Chemical Property of 2-CYANOMETHYL-3-NITRO-6-METHOXY PYRIDINE

Chemical Property:

• Vapor Pressure: 6.09E-05mmHg at 25°C
• Melting Point: 116-117℃ (ethanol )
• Refractive Index: 1.563
• Boiling Point: 345.6ºC at 760 mmHg
• PKA: -2.71±0.22(Predicted)
• Flash Point: 162.8ºC
• PSA: 91.73000
• Density: 1.334g/cm3
• LogP: 1.58768

Purity/Quality:

99% ^*data from raw suppliers

2-(6-Methoxy-3-nitropyridin-2-yl)acetonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T
• Hazard Codes: T
• Statements: 25-41
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 2-CYANOMETHYL-3-NITRO-6-METHOXY PYRIDINE

There total 2 articles about 2-CYANOMETHYL-3-NITRO-6-METHOXY PYRIDINE 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: 95.0%

2-methoxy-5-nitropyridine (5446-92-4) + (4-chlorophenoxy)acetonitrile (3598-13-8) → 2-(6-methoxy-3-nitropyridin-2-yl)acetonitrile (111795-99-4)

Guidance literature:

With potassium tert-butylate; In tetrahydrofuran; at -20 ℃; for 35h; Inert atmosphere;

DOI:10.1021/jo8011623

Reference yield: 83.0%

2-methoxy-5-nitropyridine (5446-92-4) + cyanomethylenetrimethylammonium iodide (82272-28-4) → 2-(6-methoxy-3-nitropyridin-2-yl)acetonitrile (111795-99-4)

Guidance literature:

With sodium hydride; In dimethyl sulfoxide; at 20 - 25 ℃; for 5h;

DOI:10.1055/s-2002-23546

Reference yield: 85.0%

benzyl bromide (100-39-0) + 2-(6-methoxy-3-nitropyridin-2-yl)acetonitrile (111795-99-4) → 2-(6-methoxy-3-nitropyridin-2-yl)-3-phenylpropionitrile (1060717-80-7)

Guidance literature:

With potassium carbonate; In acetonitrile; at 20 ℃; for 3h;

DOI:10.1021/jo8011623

upstream raw materials:

2-methoxy-5-nitropyridine

(4-chlorophenoxy)acetonitrile

cyanomethylenetrimethylammonium iodide

Downstream raw materials:

(3-Amino-6-methoxy-2-pyridyl)acetonitrile

5-methoxy-4-aza-1H-indole

2-cyclohexyl-2-(6-methoxy-3-nitropyrid-2-yl)acetonitrile

1-benzenesulfonyl-5-methoxy-1H-pyrrolo[3,2-b]pyridine

Refernces

• 1、 -. "3-SUBSTITUTED-1H-INDOLE, 3-SUBSTITUTED-1H-PYRROLO[2,3-B]PYRIDINE AND 3-SUBSTITUTED-1H-PYRROLO[3,2-B]PYRIDINE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES". Page/Page column 119. . Retrieved 2010/04/06.
• 2、 Jeanty, Matthieu,Suzenet, Franck,Guillaumet, Gerald. "Synthesis of C3-substituted 4-azaindoles: An easy access to 4-azamelatonin and protected 4-azatryptophan". supporting information; experimental part. p. 7390 - 7393. Retrieved 2009/05/07.