Ethyl α-acetyl-2-nitrobenzenebutanoate
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Ethyl α-acetyl-2-nitrobenzenebutanoate
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CAS No:
5339-19-5
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Formula:
C14H17NO5
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Chemical Name:
Ethyl α-acetyl-2-nitrobenzenebutanoate
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Synonyms:
Benzenebutanoic acid,α-acetyl-2-nitro-,ethyl ester;Acetoacetic acid,2-(o-nitrophenethyl)-,ethyl ester;Ethyl α-acetyl-2-nitrobenzenebutanoate;NSC 3485
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CAS No:
Computed Properties
Molecular Weight:279.29
XLogP3:2.5
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:279.11067264
Monoisotopic Mass:279.11067264
Topological Polar Surface Area:89.2
Heavy Atom Count:20
Complexity:363
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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