1-Propyl-6-fluoro-7-chloro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

Base Information

Chemical Name:1-Propyl-6-fluoro-7-chloro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
CAS No.:70032-18-7
Molecular Formula:C13H11ClFNO3
Molecular Weight:283.687
Hs Code.:
ChEMBL ID:CHEMBL2031105
DSSTox Substance ID:DTXSID001151678

Synonyms:CHEMBL2031105;SCHEMBL11028522;CTANHWYQNDDIKB-UHFFFAOYSA-N;DTXSID001151678;1-propyl-6-fluoro-7-chloro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid;70032-18-7;7-Chloro-6-fluoro-1,4-dihydro-4-oxo-1-propyl-3-quinolinecarboxylic acid

Suppliers and Price of 1-Propyl-6-fluoro-7-chloro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 1-Propyl-6-fluoro-7-chloro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

Chemical Property:

XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:283.0411491
Heavy Atom Count:19
Complexity:426

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCCN1C=C(C(=O)C2=CC(=C(C=C21)Cl)F)C(=O)O

Technology Process of 1-Propyl-6-fluoro-7-chloro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

There total 1 articles about 1-Propyl-6-fluoro-7-chloro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid 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:

: 86393-34-2
2,4-dichloro-5-fluorobenzoyl chloride

: 70032-18-7
7-Chlor-6-fluor-1-propyl-1,4-dihydro-4-oxo-3-chinolincarbonsaeure

Guidance literature:: Multi-step reaction with 6 steps

1: Mg/ethanol, CCl₄ / ethanol; toluene / 1.) 0 to -5 deg C, 2.) 12 h, room temperature

2: p-toluenesulfonic acid / H₂O / 5 h / Heating

3: acetic anhydride / 2 h / Heating

4: 82 percent / ethanol / 1 h / Ambient temperature

5: 86 percent / potassium carbonate / dimethylformamide / 2 h / 140 - 150 °C

6: 69 percent / conc. H₂SO₄ / H₂O; acetic acid / 1.5 h / Heating

With tetrachloromethane; ethanol; sulfuric acid; acetic anhydride; potassium carbonate; toluene-4-sulfonic acid; magnesium; In ethanol; water; acetic acid; N,N-dimethyl-formamide; toluene;

Reference yield:

: 70032-18-7
7-Chlor-6-fluor-1-propyl-1,4-dihydro-4-oxo-3-chinolincarbonsaeure

: 1365252-61-4
7-(4-carbamoylpiperidin-1-yl)-6-fluoro-N-(4-methoxybenzyl)-4-oxo-1-propyl-1,4-dihydroquinoline-3-carboxamide

Guidance literature:: Multi-step reaction with 3 steps

1: N,N-dimethyl-formamide / 24 h / 80 °C

2: 4-methyl-morpholine / N,N-dimethyl-formamide / 1 h / 0 °C / Inert atmosphere

3: N,N-dimethyl-formamide / 2 h / 20 °C / Inert atmosphere

With 4-methyl-morpholine; In N,N-dimethyl-formamide;
DOI:10.1021/jm101439s