Methyl 7-chloroquinoline-3-carboxylate

Base Information

• Chemical Name: Methyl 7-chloroquinoline-3-carboxylate
• CAS No.: 379699-99-7
• Molecular Formula: C₁₁H₈ClNO₂
• Molecular Weight: 221.643
• DSSTox Substance ID: DTXSID70467267
• Nikkaji Number: J1.772.347B
• Wikidata: Q82294092

Synonyms:Methyl 7-chloroquinoline-3-carboxylate;379699-99-7;DTXSID70467267;AC9150;MFCD27922632;Methyl7-chloroquinoline-3-carboxylate;SB69304;SY266640;CS-0451869

Chemical Property of Methyl 7-chloroquinoline-3-carboxylate

Chemical Property:

• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 221.0243562
• Heavy Atom Count: 15
• Complexity: 247

Purity/Quality:

95+% ^*data from raw suppliers

Methyl7-chloroquinoline-3-carboxylate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC(=O)C1=CN=C2C=C(C=CC2=C1)Cl

Technology Process of Methyl 7-chloroquinoline-3-carboxylate

There total 12 articles about Methyl 7-chloroquinoline-3-carboxylate 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%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + propynoic acid methyl ester (922-67-8) + 3-chloro-aniline (108-42-9) → 7-chloroquinoline-3-carboxylic acid methyl ester (379699-99-7)

Guidance literature:

With Au-Fe₃O₄ nanodots coated with polythiophene-polyaniline deposited on a filter paper; In water; at 20 ℃; for 5h; Irradiation;

DOI:10.1002/asia.201801556

Reference yield: 71.0%

methyl 2-{(2,4-dichlorophenyl){[(4-methylphenyl)sulfonyl]amino}methyl}acrylate (1204390-43-1) → 7-chloroquinoline-3-carboxylic acid methyl ester (379699-99-7)

Guidance literature:

With potassium carbonate; toluene-4-sulfonamide; In N,N-dimethyl-formamide; at 90 ℃; for 16h;

DOI:10.1016/j.bmc.2009.10.024

Reference yield: 58.0%

methyl (2E)-3-(4-chlorophenyl)-2-[(toluene-4-sulfonylamino)methyl]acrylate (481054-91-5) → 7-chloroquinoline-3-carboxylic acid methyl ester (379699-99-7)

Guidance literature:

methyl (2E)-3-(4-chlorophenyl)-2-[(toluene-4-sulfonylamino)methyl]acrylate; With [bis(acetoxy)iodo]benzene; iodine; In 1,2-dichloro-ethane; at 60 - 70 ℃; for 2h;

With potassium carbonate; In N,N-dimethyl-formamide; at 120 - 130 ℃; for 4h;

DOI:10.1016/S0040-4039(02)01314-X

upstream raw materials:

methyl (2E)-3-(4-chlorophenyl)-2-[(toluene-4-sulfonylamino)methyl]acrylate

methyl 3-acetoxy-3-(4-chlorophenyl)-2-methylenepropanoate

methyl 2-{(2,4-dichlorophenyl){[(4-methylphenyl)sulfonyl]amino}methyl}acrylate

ethylamine

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