3,5-Dioxohexanoic acid
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3,5-Dioxohexanoic acid
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CAS No:
2140-49-0
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Formula:
C6H8O4
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Chemical Name:
3,5-Dioxohexanoic acid
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Synonyms:
Hexanoic acid,3,5-dioxo-;3,5-Dioxohexanoic acid;Triacetic acid;Butanoic acid,4-acetyl-3-oxo-;4-Acetylacetoacetic acid
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CAS No:
Description
ChEBI: A dioxo monocarboxylic acid comprising hexanoic acid with the two oxo groups placed at the 3- and 5-positions.
Triacetic acid is a dioxo monocarboxylic acid comprising hexanoic acid with the two oxo groups placed at the 3- and 5-positions. It is a dioxo monocarboxylic acid and a beta-diketone. It is a conjugate acid of a triacetate(1-).
3,5-Dioxohexanoic acid Use and Manufacturing
Triacetic Acid is a metabolite of two species of Penicillium. Triacetic Acid is an intermediate in the fermentation of trihydroxybenzenes to acetate.
Computed Properties
Molecular Weight:144.12
XLogP3:-0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:144.04225873
Monoisotopic Mass:144.04225873
Topological Polar Surface Area:71.4
Heavy Atom Count:10
Complexity:171
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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