3-oxododecanoic acid
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3-oxododecanoic acid
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CAS No:
61058-75-1
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Formula:
C12H22O3
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Chemical Name:
3-oxododecanoic acid
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Synonyms:
3-Oxododecanoic acid;3-oxolauric acid;3-oxo-dodecanoic acid;61058-75-1;3-Oxo-Dodecanoate;Dodecanoic acid, 3-oxo-;3-OXO-LAURIC ACID;SCHEMBL337868;CHEBI:18037;ZINC1529423;LMFA01060091;C02367;Q27102781;3LA
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CAS No:
Description
Solid
3-oxolauric acid is a 3-oxo fatty acid. It derives from a dodecanoic acid. It is a conjugate acid of a 3-oxododecanoate.
3-oxododecanoic acid Use and Manufacturing
Fatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Oxo fatty acids [FA0106]
Computed Properties
Molecular Weight:214.30
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:10
Exact Mass:214.15689456
Monoisotopic Mass:214.15689456
Topological Polar Surface Area:54.4
Heavy Atom Count:15
Complexity:187
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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