ALPHA-[2-(3'-NITROPYRIDINYL)] DIETHYL MALONATE

Base Information

• Chemical Name: ALPHA-[2-(3'-NITROPYRIDINYL)] DIETHYL MALONATE
• CAS No.: 64362-41-0
• Molecular Formula: C12H14 N2 O6
• Molecular Weight: 282.253
• Hs Code.: 2933399090
• Mol file: 64362-41-0.mol

Synonyms:Propanedioicacid, (3-nitro-2-pyridinyl)-, diethyl ester (9CI); (3-Nitropyridin-2-yl)malonicacid diethyl ester; 2-(3-Nitropyridin-2-yl)malonic acid diethyl ester; Diethyl(3-nitropyridin-2-yl)malonate; Diethyl 2-(3-nitropyridin-2-yl)malonate

Chemical Property of ALPHA-[2-(3'-NITROPYRIDINYL)] DIETHYL MALONATE

Chemical Property:

• Boiling Point: 391.8±37.0 °C(Predicted)
• PKA: 8.61±0.46(Predicted)
• PSA: 111.31000
• Density: 1.297±0.06 g/cm3(Predicted)
• LogP: 1.72280

Purity/Quality:

95% ^*data from raw suppliers

diethyl2-(3-nitropyridin-2-yl)malonate 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of ALPHA-[2-(3'-NITROPYRIDINYL)] DIETHYL MALONATE

There total 5 articles about ALPHA-[2-(3'-NITROPYRIDINYL)] DIETHYL MALONATE 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%

2-Chloro-3-nitropyridine (5470-18-8,34515-82-7) + diethyl malonate (105-53-3) → diethyl 2-(3-nitropyridin-2-yl)malonate (64362-41-0)

Guidance literature:

diethyl malonate; With sodium hydride; In dimethyl sulfoxide; at 0 ℃; for 0.5h; Inert atmosphere;

2-Chloro-3-nitropyridine; In dimethyl sulfoxide; at 100 ℃; for 0.25h; Inert atmosphere;

Reference yield: 62.0%

2-Chloro-3-nitropyridine (5470-18-8,34515-82-7) + 2-Methylpentane (107-83-5) + diethyl malonate (105-53-3) → diethyl 2-(3-nitropyridin-2-yl)malonate (64362-41-0)

Guidance literature:

In N,N-dimethyl-formamide;

Reference yield:

2-Chloro-3-nitropyridine (5470-18-8,34515-82-7) + sodium diethylmalonate (996-82-7) → diethyl 2-(3-nitropyridin-2-yl)malonate (64362-41-0)

Guidance literature:

In dimethyl sulfoxide;

DOI:10.1016/j.bmcl.2003.12.002

upstream raw materials:

2-Chloro-3-nitropyridine

diethyl malonate

sodium diethylmalonate

sodium diethylmalonate

Downstream raw materials:

ethyl 2-(3-amino-pyridin-2-yl)-acetate

GW441756

ethyl pyrrolo[3,2-b]pyridine-3-carboxylate

C₂₀H₁₉N₅O₂

Refernces

• 1、 -. "NOVEL COMPOUNDS USEFUL AS POLY(ADP-RIBOSE) POLYMERASE (PARP) INHIBITORS". Paragraph 223. . Retrieved 2021/11/06.
• 2、 -. "PHARMACEUTICAL COMPOUNDS". Paragraph 0734; 0735; 0736. . Retrieved 2018/04/26.