3-Oxohexanoic Acid - CAS 4380-91-0

Catalog: BB058479
Product Name: 3-Oxohexanoic Acid
CAS: 4380-91-0
Synonyms: 3-Ketohexanoic Acid; Butanoylacetic Acid; Butyrylacetic Acid; 2-Oxopentanecarboxylic Acid
3-Oxohexanoic Acid
IUPAC Name:3-oxohexanoic acid
Description:3-Oxohexanoic Acid is an enzymatic metabolite and a building block for bacterial autoinducers.
Molecular Weight:130.14
Molecular Formula:C6H10O3
Canonical SMILES:CCCC(=O)CC(=O)O
InChI:InChI=1S/C6H10O3/c1-2-3-5(7)4-6(8)9/h2-4H2,1H3,(H,8,9)
InChI Key:BDCLDNALSPBWPQ-UHFFFAOYSA-N
Appearance:Solid
References:Naef, R., et al. J. Agric. Food Chem., 56, 517-527 (2008).

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