1.0 2016-05-27 01:28:37 UTC 2026-08-23 04:17:01 UTC 1-hexen-3-one SmallMolecule 1-hexen-3-one belongs to the carbonyl compounds, a subclass of organooxygen compounds within the organic compounds. This organic oxygen compound has the chemical formula C6H10O and an average molecular weight of 98.14 g/mol. It is utilized as an industrial nutrient and flavouring agent. The compound is present in polypropylene and has been identified in 19 recorded sources. Within the category of electrical and electronic equipment, it is found in antennas, amplifiers, auxiliary devices, electric switches, and discharge lamps, among seven other items. In the context of food, food processing, and cookware, it is associated with food contact materials, the preparation of vinegar, and fermentation processes for beer. It is also found in building and construction materials, specifically stairs and ramps. Additionally, it appears in household cleaning and consumer products, including tobacco smoke filters, soap detergents, and tobacco product cases. Recorded exposure routes for 1-hexen-3-one include oral, touch, and inhalation. C6H10O 98.145 98.073164942 hex-1-en-3-one hex-1-en-3-one 1629-60-3 CCCC(=O)C=C InChI=1S/C6H10O/c1-3-5-6(7)4-2/h4H,2-3,5H2,1H3 JTHNLKXLWOXOQK-UHFFFAOYSA-N Organic compounds Organic oxygen compounds Organooxygen compounds Carbonyl compounds Enones Acryloyl compounds Hydrocarbon derivatives Ketones Organic oxides Acryloyl-group Aliphatic acyclic compound Enone Hydrocarbon derivative Ketone Organic oxide Aliphatic acyclic compounds Detected and Not Quantified logp 1.4 logp 1.38 ALOGPS logs -1.07 ALOGPS solubility 8.30e+00 g/l ALOGPS logp 2.01 ChemAxon pka_strongest_basic -4.7 ChemAxon iupac hex-1-en-3-one ChemAxon average_mass 98.145 ChemAxon mono_mass 98.073164942 ChemAxon smiles CCCC(=O)C=C ChemAxon formula C6H10O ChemAxon inchi InChI=1S/C6H10O/c1-3-5-6(7)4-2/h4H,2-3,5H2,1H3 ChemAxon inchikey JTHNLKXLWOXOQK-UHFFFAOYSA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 30.07 ChemAxon polarizability 11.33 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f726caf5470> 15395 14654