Ethyl 2-[2-(diethylamino)ethyl]-3-oxobutanoate
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![Ethyl 2-[2-(diethylamino)ethyl]-3-oxobutanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/e375004e5cf349f8abcf429c894151eb.png "Ethyl 2-[2-(diethylamino)ethyl]-3-oxobutanoate")
Ethyl 2-[2-(diethylamino)ethyl]-3-oxobutanoate
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CAS No:
23999-02-2
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Formula:
C12H23NO3
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Chemical Name:
Ethyl 2-[2-(diethylamino)ethyl]-3-oxobutanoate
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Synonyms:
Butanoic acid,2-[2-(diethylamino)ethyl]-3-oxo-,ethyl ester;Acetoacetic acid,2-[2-(diethylamino)ethyl]-,ethyl ester;Ethyl 2-[2-(diethylamino)ethyl]-3-oxobutanoate;Ethyl 2-[2-(diethylamino)ethyl]acetoacetate;3-Carbethoxydiethylamino-4-pentanone;3-Ethoxycarbonyl-N,N-diethyl-4-oxopentylamine
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CAS No:
Ethyl 2-[2-(diethylamino)ethyl]-3-oxobutanoate Basic Attributes
229.31592
229.32
245-977-6
2922499990
Ethyl 2-[2-(diethylamino)ethyl]-3-oxobutanoate Use and Manufacturing
Use β-(diethylamino) ethanol to chlorinate with thionyl chloride under alkaline conditions to generate β-(diethylamino) chloroethane, and then condense with ethyl acetoacetate with the participation of sodium methoxide. .
The intermediate of ethylamine coumarin hydrochloride.
Computed Properties
Molecular Weight:229.32
XLogP3:1.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:9
Exact Mass:229.16779360
Monoisotopic Mass:229.16779360
Topological Polar Surface Area:46.6
Heavy Atom Count:16
Complexity:224
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Ethyl 2-[2-(diethylamino)ethyl]-3-oxobutanoate
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