1.02010-04-08 22:05:41 UTC2018-05-28 23:11:02 UTCFDB003197Dihydro-2-methyl-3(2H)-furanoneIt is used as a food additive .FEMA 3373Tetrahydro-2-methyl-3-furanoneC5H8O2100.1158100.05242952-methyloxolan-3-onecoffee furanone3188-00-9CC1OCCC1=OInChI=1S/C5H8O2/c1-4-5(6)2-3-7-4/h4H,2-3H2,1H3FCWYQRVIQDNGBI-UHFFFAOYSA-N belongs to the class of organic compounds known as furanones. Furanones are compounds containing a furan ring bearing a ketone group.FuranonesOrganic compoundsOrganoheterocyclic compoundsDihydrofuransFuranonesAliphatic heteromonocyclic compoundsCyclic ketonesDialkyl ethersHydrocarbon derivativesOrganic oxidesOxacyclic compoundsTetrahydrofurans3-furanoneAliphatic heteromonocyclic compoundCarbonyl groupCyclic ketoneDialkyl etherEtherHydrocarbon derivativeKetoneOrganic oxideOrganic oxygen compoundOrganooxygen compoundOxacycleTetrahydrofuranlogp-0.23logs0.45solubility2.85e+02 g/llogp0.44pka_strongest_acidic17.14pka_strongest_basic-4.2iupac2-methyloxolan-3-oneaverage_mass100.1158mono_mass100.0524295smilesCC1OCCC1=OformulaC5H8O2inchiInChI=1S/C5H8O2/c1-4-5(6)2-3-7-4/h4H,2-3H2,1H3inchikeyFCWYQRVIQDNGBI-UHFFFAOYSA-Npolar_surface_area26.3refractivity25.28polarizability10.22rotatable_bond_count0acceptor_count2donor_count0physiological_charge0formal_charge0Specdb::CMs11605Specdb::CMs169091Specdb::MsIr4138Specdb::MsIr4139Specdb::MsMs93201Specdb::MsMs93202Specdb::MsMs93203Specdb::MsMs156930Specdb::MsMs156931Specdb::MsMs156932Specdb::MsMs2730769Specdb::MsMs2730770Specdb::MsMs2730771Specdb::MsMs2974874Specdb::MsMs2974875Specdb::MsMs2974876breadbutterynuttysolventsweet