2-Ethylhexyl 3-oxobutanoate
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2-Ethylhexyl 3-oxobutanoate
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CAS No:
6079-97-6
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Formula:
C12H22O3
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Chemical Name:
2-Ethylhexyl 3-oxobutanoate
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Synonyms:
Butanoic acid,3-oxo-,2-ethylhexyl ester;Acetoacetic acid,2-ethylhexyl ester;2-Ethylhexyl 3-oxobutanoate;2-Ethylhexyl acetoacetate;Jessate;NSC 53798
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CAS No:
Computed Properties
Molecular Weight:214.30
XLogP3:3.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:9
Exact Mass:214.15689456
Monoisotopic Mass:214.15689456
Topological Polar Surface Area:43.4
Heavy Atom Count:15
Complexity:199
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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