ethyl quinoline-2-carboxylate
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ethyl quinoline-2-carboxylate
structure -
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CAS No:
4491-33-2
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Formula:
C12H11NO2
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Chemical Name:
ethyl quinoline-2-carboxylate
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Synonyms:
ethyl quinoline-2-carboxylate;Ethyl quinoline-2-carboxylic acid;2-Quinolinecarboxylic acid, ethyl ester;2-Quinoline carbocylic acid ethyl ester
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CAS No:
Characteristics
39.2
2.3
1.2±0.1 g/cm3
30-33 °C(Solv: ethyl ether (60-29-7))
348°C at 760 mmHg
155.8±20.4 °C
1.600
ethyl quinoline-2-carboxylate Use and Manufacturing
A mixture of quinaldine acid (5) (2.0 g, 11.55 mmol), dried K60.0 mg (0.3 mmol) of ethyl 4, 4-diethoxy-2-butenoate obtained in the step (2) and 28.0 mg (0.3 mmol) of aniline dissolved in 1 mL of acetic acid in a reactor equipped with magnetic stirring. , The mixture was stirred and reacted at 80 ° C for 6 h.The TCL stops the heating after detecting the reaction. The product and the starting material were separated by preparative thin layer chromatography (PTLC). The eluent was a mixture of petroleum ether and ethyl acetate in a volume ratio of 6:1.Finally, 40.0 mg (0.2 mmol) of the ethyl quinolin-2-carboxylate was obtained.
Computed Properties
Molecular Weight:201.22
XLogP3:2.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:201.078978594
Monoisotopic Mass:201.078978594
Topological Polar Surface Area:39.2
Heavy Atom Count:15
Complexity:230
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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