1.02010-04-08 22:09:23 UTC2018-05-28 23:29:17 UTCFDB010953Furaneol acetateIt is used in meaty and caramel-type flavours.3(2H)-Furanone, 4-(acetyloxy)-2,5-dimethyl-3(2H)-Furanone, 4-hydroxy-2,5-dimethyl-, acetate4-(Acetyloxy)-2,5-dimethyl-3(2H)-furanone4-Acetoxy-2,5-dimethyl-3(2H)-furanone4-Acetoxy-2,5-dimethyl-3(2H)furanone4-Hydroxy-2,5-dimethyl-3(2H)-furanone acetateFEMA 3797Furaneol acetateC8H10O4170.1626170.0579088082,5-dimethyl-4-oxo-4,5-dihydrofuran-3-yl acetate2,5-dimethyl-4-oxo-5H-furan-3-yl acetate4166-20-5CC1OC(C)=C(OC(C)=O)C1=OInChI=1S/C8H10O4/c1-4-7(10)8(5(2)11-4)12-6(3)9/h4H,1-3H3VPKIUOQJQJVLRW-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 ketonesEnol estersHydrocarbon derivativesMonocarboxylic acids and derivativesOrganic oxidesOxacyclic compoundsVinylogous esters3-furanoneAliphatic heteromonocyclic compoundCarbonyl groupCarboxylic acid derivativeCarboxylic acid esterCyclic ketoneEnol esterHydrocarbon derivativeKetoneMonocarboxylic acid or derivativesOrganic oxideOrganic oxygen compoundOrganooxygen compoundOxacycleVinylogous esterlogp0.53logs-0.74solubility3.08e+01 g/llogp0.12pka_strongest_acidic7.18pka_strongest_basic-4.9iupac2,5-dimethyl-4-oxo-4,5-dihydrofuran-3-yl acetateaverage_mass170.1626mono_mass170.057908808smilesCC1OC(C)=C(OC(C)=O)C1=OformulaC8H10O4inchiInChI=1S/C8H10O4/c1-4-7(10)8(5(2)11-4)12-6(3)9/h4H,1-3H3inchikeyVPKIUOQJQJVLRW-UHFFFAOYSA-Npolar_surface_area52.6refractivity42.44polarizability16.71rotatable_bond_count2acceptor_count3donor_count0physiological_charge-1formal_charge0Specdb::CMs12040Specdb::CMs131714Specdb::CMs139448Specdb::MsIr5844Specdb::MsIr5845Specdb::NmrOneD117058Specdb::NmrOneD117059Specdb::NmrOneD117060Specdb::NmrOneD117061Specdb::NmrOneD117062Specdb::NmrOneD117063Specdb::NmrOneD117064Specdb::NmrOneD117065Specdb::NmrOneD117066Specdb::NmrOneD117067Specdb::NmrOneD117068Specdb::NmrOneD117069Specdb::NmrOneD117070Specdb::NmrOneD117071Specdb::NmrOneD117072Specdb::NmrOneD117073Specdb::NmrOneD117074Specdb::NmrOneD117075Specdb::NmrOneD117076Specdb::NmrOneD117077Specdb::MsMs54270Specdb::MsMs54271Specdb::MsMs54272Specdb::MsMs145545Specdb::MsMs145546Specdb::MsMs145547Specdb::MsMs2287917Specdb::MsMs2287918Specdb::MsMs2287919Specdb::MsMs2648391Specdb::MsMs2648392Specdb::MsMs2648393HMDB32966#<Reference:0x0000555674827e98>bakedbreadbrowncaramelfruitymolassessugarsweettoffeetropical