4-Bromo-2-phenylquinoline

Base Information

• Chemical Name: 4-Bromo-2-phenylquinoline
• CAS No.: 5427-93-0
• Molecular Formula: C15H10BrN
• Molecular Weight: 284.155
• Hs Code.: 2933499090
• NSC Number: 12822
• DSSTox Substance ID: DTXSID10279487
• Wikidata: Q82012103
• Mol file: 5427-93-0.mol

Synonyms:4-bromo-2-phenylquinoline;5427-93-0;NSC12822;SCHEMBL4559016;DTXSID10279487;MFCD12674831;NSC 12822;NSC-12822;AKOS015899753;SB72038;AS-76516;CS-0156367;FT-0768104;D95000;A870500

Chemical Property of 4-Bromo-2-phenylquinoline

Chemical Property:

• Vapor Pressure: 3.41E-06mmHg at 25°C
• Melting Point: 90-90.5 °C
• Boiling Point: 398.4°Cat760mmHg
• PKA: 2.90±0.13(Predicted)
• Flash Point: 194.7°C
• PSA: 12.89000
• Density: 1.433g/cm³
• LogP: 4.66430
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 282.99966
• Heavy Atom Count: 17
• Complexity: 249

Purity/Quality:

97% ^*data from raw suppliers

4-Bromo-2-phenylquinoline 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)Br

Technology Process of 4-Bromo-2-phenylquinoline

There total 6 articles about 4-Bromo-2-phenylquinoline 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: 73.0%

3-(2-aminophenyl)-1-phenyl-2-propyn-1-one (180689-33-2) → 4-bromo-2-phenylquinoline (5427-93-0)

Guidance literature:

With hydrogen bromide; at 20 ℃;

DOI:10.1016/j.mencom.2008.03.020

Reference yield: 46.0%

C15H11N3O (1449379-67-2) → 4-bromo-2-phenylquinoline (5427-93-0)

Guidance literature:

With trimethylsilyl bromide; In nitromethane; at 60 ℃; for 1h; Sealed tube;

DOI:10.3390/molecules24213999

Reference yield: 34.0%

4-bromoquinoline (3964-04-3,850917-90-7) + phenylboronic acid (98-80-6) → 4-bromo-2-phenylquinoline (5427-93-0)

Guidance literature:

4-bromoquinoline; phenylboronic acid; With Selectfluor; trifluoroacetic acid; In dichloromethane; water; at 20 ℃; for 0.0166667h;

With silver nitrate; In dichloromethane; water; at 50 ℃;

DOI:10.1021/acs.orglett.7b02706

upstream raw materials:

2-phenylquinolin-4-amine

2-phenyl-4-quinolinol

phosphorus pentabromide

3-(2-aminophenyl)-1-phenyl-2-propyn-1-one