Dimethyl 2-(3-nitropyridin-2-yl)malonate

Base Information

Chemical Name:Dimethyl 2-(3-nitropyridin-2-yl)malonate
CAS No.:173417-34-0
Molecular Formula:C₁₀H₁₀N₂O₆
Molecular Weight:254.199
Hs Code.:2933399090
DSSTox Substance ID:DTXSID50381972
Wikidata:Q82173207
ChEMBL ID:CHEMBL1321530
Mol file:173417-34-0.mol

Synonyms:Dimethyl 2-(3-nitropyridin-2-yl)malonate;173417-34-0;dimethyl 2-(3-nitropyridin-2-yl)propanedioate;dimethyl 2-(3-nitro-2-pyridyl)malonate;Oprea1_803800;MLS000861429;SCHEMBL2001299;CHEMBL1321530;DTXSID50381972;ZGJBYLKQNZJCFD-UHFFFAOYSA-N;HMS2809H10;YGA41734;CCG-43104;MFCD00203481;AKOS015833366;AS-48019;SMR000460213;Dimethyl-2-(3-nitropyridin-2-yl)malonate;CS-0089817;FT-0625052;F17550;SR-01000633053-1;Z1170274340;Propanedioic acid,2-(3-nitro-2-pyridinyl)-,1,3-dimethylester;Propanedioic acid, 2-(3-nitro-2-pyridinyl)-, 1,3-dimethyl ester

Suppliers and Price of Dimethyl 2-(3-nitropyridin-2-yl)malonate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Crysdot
Dimethyl2-(3-nitropyridin-2-yl)malonate 95+%
25g
$ 452.00

American Custom Chemicals Corporation
DIMETHYL 2-(3-NITROPYRIDIN-2-YL)MALONATE 95.00%
5G
$ 1281.93

American Custom Chemicals Corporation
DIMETHYL 2-(3-NITROPYRIDIN-2-YL)MALONATE 95.00%
1G
$ 701.20

Total 15 raw suppliers

Chemical Property of Dimethyl 2-(3-nitropyridin-2-yl)malonate

Chemical Property:

Vapor Pressure:1.41E-05mmHg at 25°C
Boiling Point:366.9oC at 760 mmHg
Flash Point:175.7oC
PSA：111.31000
Density:1.377g/cm3
LogP:0.94260
Storage Temp.:Room temperature.
XLogP3:0.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:254.05388604
Heavy Atom Count:18
Complexity:324

Purity/Quality:

99% ^*data from raw suppliers

Dimethyl2-(3-nitropyridin-2-yl)malonate 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)C(C1=C(C=CC=N1)[N+](=O)[O-])C(=O)OC

Technology Process of Dimethyl 2-(3-nitropyridin-2-yl)malonate

There total 2 articles about Dimethyl 2-(3-nitropyridin-2-yl)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: 44.0%

: 5470-18-8,34515-82-7
2-Chloro-3-nitropyridine

: 108-59-8
malonic acid dimethyl ester

: 173417-34-0
dimethyl 2-(3-nitropyridin-2-yl)malonate

Guidance literature:: With sodium hydride; In N,N-dimethyl-formamide; mineral oil; at 20 ℃; for 5h; Inert atmosphere;

Reference yield:

: 5470-18-8,34515-82-7
2-Chloro-3-nitropyridine

: NaH mineral oil

: 60-29-7,927820-24-4
diethyl ether

: 108-59-8
malonic acid dimethyl ester

: 173417-34-0
dimethyl 2-(3-nitropyridin-2-yl)malonate

Guidance literature:: With NaH; In N,N-dimethyl-formamide;

Reference yield:

: 173417-34-0
dimethyl 2-(3-nitropyridin-2-yl)malonate

: 65156-92-5,343569-94-8
(E)-N,N-dimethyl-2-(3-nitropyridin-2-yl)ethenamine

Guidance literature:: Multi-step reaction with 2 steps

1: hydrogenchloride / water / 8 h / Reflux

2: N,N-dimethyl-formamide / 4 h / 90 °C / Inert atmosphere

With hydrogenchloride; In water; N,N-dimethyl-formamide;