5-Nitroquinoline-2-carbaldehyde

Base Information

• Chemical Name: 5-Nitroquinoline-2-carbaldehyde
• CAS No.: 59394-31-9
• Molecular Formula: C₁₀H₆N₂O₃
• Molecular Weight: 202.169
• DSSTox Substance ID: DTXSID60406120
• Wikidata: Q82211011
• ChEMBL ID: CHEMBL2042579

Synonyms:5-nitroquinoline-2-carbaldehyde;59394-31-9;SCHEMBL4818968;CHEMBL2042579;QRNHAJDHLIRMED-UHFFFAOYSA-;DTXSID60406120;QRNHAJDHLIRMED-UHFFFAOYSA-N;STL227742;AKOS000267826;F2147-1340;InChI=1/C10H6N2O3/c13-6-7-4-5-8-9(11-7)2-1-3-10(8)12(14)15/h1-6H

Chemical Property of 5-Nitroquinoline-2-carbaldehyde

Chemical Property:

• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 202.03784206
• Heavy Atom Count: 15
• Complexity: 264

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC2=C(C=CC(=N2)C=O)C(=C1)[N+](=O)[O-]

Technology Process of 5-Nitroquinoline-2-carbaldehyde

There total 1 articles about 5-Nitroquinoline-2-carbaldehyde 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:

2-methylquinoline (91-63-4) → 6-nitroquinoline-2-carbaldehyde (59500-67-3) + 5-nitro-2-quinolinecarboxyaldehyde (59394-31-9)

Guidance literature:

2-methylquinoline; With sulfuric acid; nitric acid; at 0 - 120 ℃; for 4h;

With selenium(IV) oxide; In 1,4-dioxane; for 3h; Inert atmosphere; Reflux;

DOI:10.1021/ol400605x

upstream raw materials:

2-methylquinoline

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