1.02010-04-08 22:05:38 UTC2020-02-24 19:10:40 UTCFDB0030522-HexadecanoneIsolated from hop oil (Humulus lupulus). 2-Hexadecanone is found in alcoholic beverages and fats and oils.3-hexadecanonehexadecan-2-oneMethyl tetradecyl ketoneC16H32O240.4247240.245315646hexadecan-2-onehexadecan-2-one18787-63-8CCCCCCCCCCCCCCC(C)=OInChI=1S/C16H32O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(2)17/h3-15H2,1-2H3XCXKZBWAKKPFCJ-UHFFFAOYSA-N belongs to the class of organic compounds known as ketones. These are organic compounds in which a carbonyl group is bonded to two carbon atoms R2C=O (neither R may be a hydrogen atom). Ketones that have one or more alpha-hydrogen atoms undergo keto-enol tautomerization, the tautomer being an enol.KetonesOrganic compoundsOrganic oxygen compoundsOrganooxygen compoundsCarbonyl compoundsAliphatic acyclic compoundsHydrocarbon derivativesOrganic oxidesAliphatic acyclic compoundHydrocarbon derivativeKetoneOrganic oxideOxygenated hydrocarbonslogp6.93logs-6.32solubility1.16e-04 g/lmelting_pointMp 43-43.5°logp6.14pka_strongest_acidic19.64pka_strongest_basic-7.3iupachexadecan-2-oneaverage_mass240.4247mono_mass240.245315646smilesCCCCCCCCCCCCCCC(C)=OformulaC16H32OinchiInChI=1S/C16H32O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(2)17/h3-15H2,1-2H3inchikeyXCXKZBWAKKPFCJ-UHFFFAOYSA-Npolar_surface_area17.07refractivity76.03polarizability33.28rotatable_bond_count13acceptor_count1donor_count0physiological_charge0formal_charge0Specdb::CMs23331Specdb::CMs29179Specdb::CMs100586Specdb::CMs167546Specdb::MsMs12305Specdb::MsMs12306Specdb::MsMs12307Specdb::MsMs18977Specdb::MsMs18978Specdb::MsMs18979Specdb::MsMs2351326Specdb::MsMs2351327Specdb::MsMs2351328Specdb::MsMs2584028Specdb::MsMs2584029Specdb::MsMs2584030HMDB31052#<Reference:0x000055567639a0e0>Alcoholic beveragesUnknowngenericCauliflowerType 1specificBrassica oleracea var. botrytis3715Fats and oilsUnknowngenericfruitfruity