7-Bromo-2-methoxyquinoline

Base Information

• Chemical Name: 7-Bromo-2-methoxyquinoline
• CAS No.: 99455-08-0
• Molecular Formula: C₁₀H₈BrNO
• Molecular Weight: 238.084
• Hs Code.: 2933499090
• DSSTox Substance ID: DTXSID10557555
• Wikidata: Q82439504
• Mol file: 99455-08-0.mol

Synonyms:7-Bromo-2-methoxyquinoline;99455-08-0;MFCD11877930;Quinoline,7-bromo-2-methoxy;SCHEMBL2332151;Quinoline, 7-bromo-2-methoxy-;DTXSID10557555;AKOS016010841;CS-W022528;DS-6158;MB10600;SY111512;EN300-3559228;A858464

Chemical Property of 7-Bromo-2-methoxyquinoline

Chemical Property:

• Melting Point: 68 °C
• Boiling Point: 312.6±22.0 °C(Predicted)
• PKA: 1.62±0.50(Predicted)
• PSA: 22.12000
• Density: 1.516±0.06 g/cm3(Predicted)
• LogP: 3.00590
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 236.97893
• Heavy Atom Count: 13
• Complexity: 176

Purity/Quality:

97% ^*data from raw suppliers

7-Bromo-2-methoxyquinoline 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=NC2=C(C=CC(=C2)Br)C=C1

Technology Process of 7-Bromo-2-methoxyquinoline

There total 4 articles about 7-Bromo-2-methoxyquinoline 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: 98.0%

sodium methylate (124-41-4) + 7-bromo-2-chloro-quinoline (99455-15-9) → 7-bromo-2-methoxyquinoline (99455-08-0)

Guidance literature:

With methanol; for 15h; Reflux;

DOI:10.1016/j.ejmech.2010.01.003

Reference yield:

7-bromo-1,2-dihydroquinolin-2-one (99465-10-8) → 7-bromo-2-methoxyquinoline (99455-08-0)

Guidance literature:

Multi-step reaction with 2 steps

1: POCl₃ / Heating

2: methanol / Heating

With trichlorophosphate; In methanol;

DOI:10.1021/jm00118a034

Reference yield:

(E)-N-(3-bromophenyl)-3-ethoxypropenamide (99465-18-6) → 7-bromo-2-methoxyquinoline (99455-08-0)

Guidance literature:

Multi-step reaction with 3 steps

1: 98percent H₂SO₄ / Ambient temperature

2: POCl₃ / Heating

3: methanol / Heating

With sulfuric acid; trichlorophosphate; In methanol;

DOI:10.1021/jm00118a034

upstream raw materials:

sodium methylate

7-bromo-2-chloro-quinoline

7-bromo-1,2-dihydroquinolin-2-one

(E)-N-(3-bromophenyl)-3-ethoxypropenamide

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