6-Bromo-2,4-dichloroquinoline

Base Information

• Chemical Name: 6-Bromo-2,4-dichloroquinoline
• CAS No.: 406204-90-8
• Molecular Formula: C9H4BrCl2N
• Molecular Weight: 276.947
• Hs Code.: 2933499090
• European Community (EC) Number: 867-309-8
• DSSTox Substance ID: DTXSID80695392
• Wikidata: Q82624561
• Mol file: 406204-90-8.mol

Synonyms:6-BROMO-2,4-DICHLOROQUINOLINE;406204-90-8;Quinoline, 6-bromo-2,4-dichloro-;SCHEMBL4015829;6-Bromo-2,4-dichloro quinoline;DTXSID80695392;CRFXLQFAIWSWIV-UHFFFAOYSA-N;AMY13681;MFCD11847521;AKOS016010995;DS-5787;SB71549;EN300-374051;A873274

Chemical Property of 6-Bromo-2,4-dichloroquinoline

Chemical Property:

• Boiling Point: 342.2±37.0 °C(Predicted)
• PKA: -1.93±0.50(Predicted)
• PSA: 12.89000
• Density: 1.765±0.06 g/cm3(Predicted)
• LogP: 4.30410
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 274.89042
• Heavy Atom Count: 13
• Complexity: 191

Purity/Quality:

98% ^*data from raw suppliers

6-Bromo-2,4-dichloroquinoline 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=C1Br)C(=CC(=N2)Cl)Cl

Technology Process of 6-Bromo-2,4-dichloroquinoline

There total 8 articles about 6-Bromo-2,4-dichloroquinoline 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: 72.0%

6-bromo-2-hydroxyquinolin-4(1H)-one (2254506-51-7) → 6-bromo-2,4-dichloroquinoline (406204-90-8)

Guidance literature:

With trichlorophosphate; at 100 ℃; for 15h;

Reference yield: 48.4%

malonic acid (141-82-2) + 4-bromo-aniline (106-40-1) → 6-bromo-2,4-dichloroquinoline (406204-90-8)

Guidance literature:

With trichlorophosphate; at 100 ℃; for 6h;

DOI:10.1016/j.bioorg.2021.105174

Reference yield:

6-bromo-4-hydroxyquinoline-2(1H)-one (54675-23-9) → 6-bromo-2,4-dichloroquinoline (406204-90-8)

Guidance literature:

With trichlorophosphate; at 105 ℃;

upstream raw materials:

malonic acid

4-bromo-aniline

6-bromo-4-hydroxyquinoline-2(1H)-one

3-[(4-bromophenyl)amino]-3-oxopropanoic acid

Downstream raw materials:

4-((6-bromo-4-chloro-2-methoxyquinolin-3-yl)methyl)benzonitrile

4-((6-bromo-2,4-dichloroquinolin-3-yl)methyl)benzonitrile

diethyl 4-(4-(6-bromo-2-chloroquinolin-4-yloxy)phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

dimethyl 4-(4-(6-bromo-2-chloroquinolin-4-yloxy)phenyl)-2,6-dimethyl-1,4-dihydro pyridine-3,5-dicarboxylate

Refernces

• 1、 Elbastawesy, Mohammed A. I.,El-Shaier, Yaseen A. M. M.,Ramadan, Mohamed,Brown, Alan B.,Aly, Ashraf A.,Abuo-Rahma, Gamal El-Din A.. "Identification and molecular modeling of new quinolin-2-one thiosemicarbazide scaffold with antimicrobial urease inhibitory activity". . p. 13 - 27. Retrieved 2020/01/22.
• 2、 -. "COMPOUNDS FOR TREATING HUNTINGTON'S DISEASE". . . Retrieved 2019/01/06.