1.02010-04-08 22:08:08 UTC2019-11-26 03:02:46 UTCFDB008543NorfuraneolIsolated from oil of figs and from guava. Beef flavouring ingredient. Norfuraneol is found in fruits.3(2H)-Furanone, 4-hydroxy-5-methyl-4-Hydroxy-5-methyl-2,3-dihydrofuran-3-one4-Hydroxy-5-methyl-3-furanone4-Hydroxy-5-methyl-3(2H)-furanone4-Hydroxy-5-methylfuran-3(2H)-one5-Methyl-4-hydroxy-3(2H)-furanoneNorfuraneolC5H6O3114.0993114.0316940584-hydroxy-5-methyl-2,3-dihydrofuran-3-one4-hydroxy-5-methyl-2H-furan-3-one19322-27-1CC1=C(O)C(=O)CO1InChI=1S/C5H6O3/c1-3-5(7)4(6)2-8-3/h7H,2H2,1H3DLVYTANECMRFGX-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 ketonesHydrocarbon derivativesOrganic oxidesOxacyclic compoundsVinylogous esters3-furanoneAliphatic heteromonocyclic compoundCarbonyl groupCyclic ketoneHydrocarbon derivativeKetoneOrganic oxideOrganic oxygen compoundOrganooxygen compoundOxacycleVinylogous estercyclic ketoneenolfuranslogp-0.83logs0.73solubility6.16e+02 g/lmelting_pointMp 126.6-127.5° (dec.)logp-0.36pka_strongest_acidic6.88pka_strongest_basic-4.4iupac4-hydroxy-5-methyl-2,3-dihydrofuran-3-oneaverage_mass114.0993mono_mass114.031694058smilesCC1=C(O)C(=O)CO1formulaC5H6O3inchiInChI=1S/C5H6O3/c1-3-5(7)4(6)2-8-3/h7H,2H2,1H3inchikeyDLVYTANECMRFGX-UHFFFAOYSA-Npolar_surface_area46.53refractivity28.8polarizability10.5rotatable_bond_count0acceptor_count3donor_count1physiological_charge-1formal_charge0Specdb::CMs12641Specdb::CMs42639Specdb::CMs170467Specdb::MsIr4967Specdb::MsIr4968Specdb::MsIr4969Specdb::NmrOneD20062Specdb::NmrOneD20063Specdb::NmrOneD20064Specdb::NmrOneD20065Specdb::NmrOneD20066Specdb::NmrOneD20067Specdb::NmrOneD20068Specdb::NmrOneD20069Specdb::NmrOneD20070Specdb::NmrOneD20071Specdb::NmrOneD20072Specdb::NmrOneD20073Specdb::NmrOneD20074Specdb::NmrOneD20075Specdb::NmrOneD20076Specdb::NmrOneD20077Specdb::NmrOneD20078Specdb::NmrOneD20079Specdb::NmrOneD20080Specdb::NmrOneD20081Specdb::MsMs71559Specdb::MsMs71560Specdb::MsMs71561Specdb::MsMs130260Specdb::MsMs130261Specdb::MsMs130262Specdb::MsMs2434048Specdb::MsMs2434049Specdb::MsMs2434050Specdb::MsMs2505401Specdb::MsMs2505402Specdb::MsMs2505403HMDB31859#<Reference:0x00005556755f3ba8>BeerType 2specific0.00.00.0mg/100 gBlackberryType 1specificRubusEvergreen blackberryType 1specificRubus laciniatusFruitsUnknowngenericbreadycandycaramelcottonsugarsweet