3-Bromo-2-iodoquinoline

Base Information

• Chemical Name: 3-Bromo-2-iodoquinoline
• CAS No.: 898559-23-4
• Molecular Formula: C₉H₅BrIN
• Molecular Weight: 333.954
• Hs Code.: 2933499090
• European Community (EC) Number: 685-064-3
• DSSTox Substance ID: DTXSID10708025
• Nikkaji Number: J3.255.306K
• Wikidata: Q82642053
• Mol file: 898559-23-4.mol

Synonyms:3-Bromo-2-iodoquinoline;898559-23-4;bromo-iodoquinoline;2-Iodo-3-bromoquinoline;SCHEMBL1258641;3-Bromo-2-iodoquinoline, 97%;DTXSID10708025;YKB55923;MFCD16621398;AKOS025394907;SB72182;CS-0195046;EN300-268014;F30333

Chemical Property of 3-Bromo-2-iodoquinoline

Chemical Property:

• Melting Point: 117-123°C
• PSA: 12.89000
• LogP: 3.60190
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 332.86501
• Heavy Atom Count: 12
• Complexity: 165

Purity/Quality:

95% ^*data from raw suppliers

3-Bromo-2-iodoquinoline ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22-37/38-41
• Safety Statements: 26-39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=C(C(=N2)I)Br

Technology Process of 3-Bromo-2-iodoquinoline

There total 7 articles about 3-Bromo-2-iodoquinoline 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: 97.0%

3-bromo-2-chloro-quinoline (101870-60-4) → 3-bromo-2-iodoquinoline (898559-23-4)

Guidance literature:

3-bromo-2-chloro-quinoline; With hydrogenchloride; In diethyl ether; dichloromethane; at 5 - 20 ℃; for 1h;

With sodium iodide; In acetonitrile; for 5h; Reflux;

DOI:10.1016/j.tet.2013.08.019

Reference yield: 96.0%

→ 3-bromo-2-iodoquinoline (898559-23-4)

Guidance literature:

Reference yield: 87.0%

3-bromoquinoline (5332-24-1) → 3-bromo-2-iodoquinoline (898559-23-4)

Guidance literature:

3-bromoquinoline; With N-tetramethylpiperidine magnesium chloride; lithium chloride; In tetrahydrofuran; at -30 ℃; for 0.3h;

With iodine; In tetrahydrofuran; at -30 ℃;

DOI:10.1002/anie.200504024

upstream raw materials:

3-bromoquinoline

1-Chloro-4-iodobenzene

3-bromoquinoline N-oxide

3-bromoquinolin-2-one

Downstream raw materials:

3-bromo-2-(trifluoromethyl)quinoline

10-benzyl-10H-indolo[3,2-b]quinoline