1-Methyl-[1,2,4]triazolo[4,3-a]quinoline

Base Information

• Chemical Name: 1-Methyl-[1,2,4]triazolo[4,3-a]quinoline
• CAS No.: 35359-22-9
• Molecular Formula: C11H9N3
• NSC Number: 76484
• DSSTox Substance ID: DTXSID50291567
• Nikkaji Number: J3.241.454K
• Wikidata: Q82029559
• ChEMBL ID: CHEMBL1491707
• Mol file: 35359-22-9.mol

Synonyms:1-methyl-[1,2,4]triazolo[4,3-a]quinoline;35359-22-9;MLS000736832;1-methyl[1,2,4]triazolo[4,3-a]quinoline;CHEMBL1491707;SMR000027494;[1,2,4]triazolo[4,3-a]quinoline, 1-methyl-;NSC76484;NCIOpen2_000801;MLS000092417;SCHEMBL11777629;DTXSID50291567;VYRUZHMGBQXYTF-UHFFFAOYSA-N;HMS2421M20;BDBM50198451;NSC-76484;STK741651;AKOS001739709;1-METHYL-s-TRIAZOLO(4,3-a)QUINOLINE;SR-01000523070;SR-01000523070-1

Chemical Property of 1-Methyl-[1,2,4]triazolo[4,3-a]quinoline

Chemical Property:

• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 183.079647300
• Heavy Atom Count: 14
• Complexity: 219

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NN=C2N1C3=CC=CC=C3C=C2

Technology Process of 1-Methyl-[1,2,4]triazolo[4,3-a]quinoline

There total 8 articles about 1-Methyl-[1,2,4]triazolo[4,3-a]quinoline 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: 90.0%

2-hydrazinoquinoline (15793-77-8) + Nitroethane (79-24-3) → 1-methyl-[1,2,4]triazolo[4,3-a]quinoline (35359-22-9)

Guidance literature:

Nitroethane; With polyphosphoric acid; at 130 ℃;

2-hydrazinoquinoline; at 130 ℃;

DOI:10.1039/d0ob01007c

Reference yield: 82.0%

2-hydrazinoquinoline (15793-77-8) + ethyl acetimidate hydrochloride (2208-07-3) → 1-methyl-[1,2,4]triazolo[4,3-a]quinoline (35359-22-9)

Guidance literature:

With sodium acetate; acetic acid; In ethanol; at 50 ℃; for 1h;

DOI:10.1016/j.tetlet.2013.08.024

Reference yield: 30.0%

1-α-morpholinoethylidene-2-quinolinohydrazine (76226-67-0) → 1-methyl-[1,2,4]triazolo[4,3-a]quinoline (35359-22-9)

Guidance literature:

With acetic acid; Heating;

upstream raw materials:

2-hydrazinoquinoline

acetic anhydride

Triethyl orthoacetate

1-α-morpholinoethylidene-2-quinolinohydrazine

Downstream raw materials:

2-ethyl-1-(4-dimethylamino-styryl)-[1,2,4]triazolo[4,3-a]quinolinium; iodide

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