2-Chloroquinoline-4-carbonyl chloride

Base Information

• Chemical Name: 2-Chloroquinoline-4-carbonyl chloride
• CAS No.: 2388-32-1
• Molecular Formula: C10H5Cl2NO
• Molecular Weight: 226.062
• Hs Code.: 2933499090
• European Community (EC) Number: 219-220-5
• UNII: 8D94UC3LJB
• DSSTox Substance ID: DTXSID50178581
• Nikkaji Number: J28.242A
• Wikidata: Q72459293
• Mol file: 2388-32-1.mol

Synonyms:2-Chloroquinoline-4-carbonyl chloride;2388-32-1;2-Chloro quinoline-4-chloroformyl;2-chloro-4-quinolinecarbonyl chloride;8D94UC3LJB;EINECS 219-220-5;C10H5Cl2NO;2-Chloro-quinoline-4-carbonyl chloride;4-Quinolinecarbonyl chloride, 2-chloro-;2-Chloroquinoline-4-carbonylchloride;MFCD06654888;UNII-8D94UC3LJB;SCHEMBL1613027;C10-H5-Cl2-N-O;DTXSID50178581;2-Chloro-4-chlorocarbonylquinoline;AKOS000121769;FT-0600799;EN300-00880;A816961;F8881-7609;Z119988648

Chemical Property of 2-Chloroquinoline-4-carbonyl chloride

Chemical Property:

• Vapor Pressure: 8.17E-05mmHg at 25°C
• Melting Point: 89 °C(Solv: benzene (71-43-2))
• Refractive Index: 1.66
• Boiling Point: 341.2 °C at 760 mmHg
• PKA: -2.82±0.50(Predicted)
• Flash Point: 160.2 °C
• PSA: 29.96000
• Density: 1.457 g/cm³
• LogP: 3.26720
• Storage Temp.: 2-8°C
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 224.9748192
• Heavy Atom Count: 14
• Complexity: 234

Purity/Quality:

99% ^*data from raw suppliers

2-Chloroquinoline-4-carbonylChloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=CC(=N2)Cl)C(=O)Cl

Technology Process of 2-Chloroquinoline-4-carbonyl chloride

There total 6 articles about 2-Chloroquinoline-4-carbonyl chloride 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:

2-chloroquinoline-4-carboxylic acid (5467-57-2) → 2-chloroquinoline-4-carbonyl chloride (2388-32-1)

Guidance literature:

With thionyl chloride; for 1h; Heating;

DOI:10.1007/BF02510092

Reference yield:

2-hydroxyquinoline-4-carboxylic acid (15733-89-8,84906-81-0) → 2-chloroquinoline-4-carbonyl chloride (2388-32-1)

Guidance literature:

With phosphorus pentachloride; chlorine; 1,2-dichloro-ethane;

Reference yield:

2-quinolone-4-carboxylic acid (15733-89-8) → 2-chloroquinoline-4-carbonyl chloride (2388-32-1)

Guidance literature:

2-quinolone-4-carboxylic acid; With trichlorophosphate; for 3h; Heating;

With thionyl chloride; for 2h; Heating;

DOI:10.1021/jm0493461

upstream raw materials:

2-hydroxyquinoline-4-carboxylic acid

2-chloroquinoline-4-carboxylic acid

2-quinolone-4-carboxylic acid

indole-2,3-dione

Downstream raw materials:

(2-chloroquinolin-4-yl)(piperidin-1-yl)methanone

1-(2-chloro-quinoline-4-carbonyl)-4-phenyl-piperazine

2-(n-butyloxy)-4-(n-butyloxycarbonyl)-quinoline

2-chloro-quinoline-4-carboxylic acid-(2-diethylamino-ethylamide)

Refernces

• 1、 Pavlova,Mikhalev,Kon'shin,Zaks,Vasilyuk,Vakhrin. "Synthesis and antiinflammatory and analgesic activity of 2-substituted cinchoninic acid amides". . p. 419 - 420. Retrieved 1999.
• 2、 Li, Wenlong,Xu, Feijie,Shuai, Wen,Sun, Honghao,Yao, Hong,Ma, Cong,Xu, Shengtao,Yao, Hequan,Zhu, Zheying,Yang, Dong-Hua,Chen, Zhe-Sheng,Xu, Jinyi. "Discovery of Novel Quinoline-Chalcone Derivatives as Potent Antitumor Agents with Microtubule Polymerization Inhibitory Activity". . p. 993 - 1013. Retrieved 2019/01/11.