1-(6-Chloro-2-methyl-4-phenylquinolin-3-yl)ethanone

Base Information

• Chemical Name: 1-(6-Chloro-2-methyl-4-phenylquinolin-3-yl)ethanone
• CAS No.: 22609-02-5
• Molecular Formula: C18H14ClNO
• Molecular Weight: 295.768
• DSSTox Substance ID: DTXSID50350047
• Nikkaji Number: J1.982.027K
• Wikidata: Q82125760
• ChEMBL ID: CHEMBL3920327
• Mol file: 22609-02-5.mol

Synonyms:1-(6-chloro-2-methyl-4-phenylquinolin-3-yl)ethanone;22609-02-5;Ethanone, 1-(6-chloro-2-methyl-4-phenyl-3-quinolinyl)-;1-(6-Chloro-2-methyl-4-phenyl-3-quinolyl)ethanone;SCHEMBL2820951;CHEMBL3920327;DTXSID50350047;AKOS001263867;UPCMLD0ENAT5605099:001;NCGC00321449-01;2-Methyl-3-acetyl-4-phenyl-6-chloroquinoline;6-chloro-3-acetyl-2-methyl-4-phenylquinoline;AB01316709-02;SR-01000420395;SR-01000420395-1;Z57110708

Chemical Property of 1-(6-Chloro-2-methyl-4-phenylquinolin-3-yl)ethanone

Chemical Property:

• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 295.0763918
• Heavy Atom Count: 21
• Complexity: 379

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=C2C=C(C=CC2=N1)Cl)C3=CC=CC=C3)C(=O)C

Technology Process of 1-(6-Chloro-2-methyl-4-phenylquinolin-3-yl)ethanone

There total 3 articles about 1-(6-Chloro-2-methyl-4-phenylquinolin-3-yl)ethanone 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: 99.0%

5-chloro-2-aminobenzophenone (719-59-5) + acetylacetone (123-54-6,81235-32-7) → 1-(6-chloro-2-methyl-4-phenylquinolin-3-yl)ethanone (22609-02-5)

Guidance literature:

With sulfuric acid; silica gel; at 100 ℃; for 0.75h;

DOI:10.1007/s00706-005-0413-9

Reference yield: 86.0%

acetylacetone (123-54-6,81235-32-7) + (2-aminophenyl)(phenyl)methanone (2835-77-0) → 1-(6-chloro-2-methyl-4-phenylquinolin-3-yl)ethanone (22609-02-5)

Guidance literature:

With benzyltrimethylazanium tetrachloro-λ³-iodanuide; acetic acid; at 20 ℃; for 12h; Sealed vessel;

DOI:10.1007/s00706-009-0170-2

Reference yield:

→ 1-(6-chloro-2-methyl-4-phenylquinolin-3-yl)ethanone (22609-02-5)

Guidance literature:

2-Amino-5-chlor-benzophenon, Acetylaceton, H2SO4, in Eisessig, Rueckfluss;

upstream raw materials:

5-chloro-2-aminobenzophenone

acetylacetone

(2-aminophenyl)(phenyl)methanone

Downstream raw materials:

1-(6-chloro-2-methyl-4-phenylquinolin-3-yl)ethanol

C₂₃H₁₆ClNO₂

C₂₃H₁₆ClNOS

C₂₆H₂₀ClNO