1.0 2010-04-08 22:10:14 UTC 2019-11-26 03:07:00 UTC FDB012541 Mesifurane Constituent of various fruits including raspberry, strawberry, mango, pineapple, blackberry and cape gooseberry. Flavouring agent. Mesifurane is found in fruits. 2,5-dimethyl 4-methoxy furan-3-one 2,5-dimethyl-4-methoxy-2,3-dihydro-3-furanone 2,5-Dimethyl-4-methoxy-3(2H)-furanone 3(2H)-Furanone, 2,5-dimethyl-4-methoxy 3(2H)-Furanone, 4-methoxy-2,5-dimethyl- 4-Methoxy-2,5-dimethyl-2,3-dihydrofuran-3-one 4-Methoxy-2,5-dimethyl-3(2H)-furanone 4-Methoxy-2,5-dimethylfuran-3(2H)-one FEMA 3664 Mesifuran Mesifurane O-Methylfuraneol C7H10O3 142.1525 142.062994186 4-methoxy-2,5-dimethyl-2,3-dihydrofuran-3-one 4-methoxy-2,5-dimethyl-2H-furan-3-one 4077-47-8 COC1=C(C)OC(C)C1=O InChI=1S/C7H10O3/c1-4-6(8)7(9-3)5(2)10-4/h4H,1-3H3 SIMKGHMLPVDSJE-UHFFFAOYSA-N belongs to the class of organic compounds known as furanones. Furanones are compounds containing a furan ring bearing a ketone group. Furanones Organic compounds Organoheterocyclic compounds Dihydrofurans Furanones Aliphatic heteromonocyclic compounds Cyclic ketones Hydrocarbon derivatives Organic oxides Oxacyclic compounds Vinylogous esters 3-furanone Aliphatic heteromonocyclic compound Carbonyl group Cyclic ketone Hydrocarbon derivative Ketone Organic oxide Organic oxygen compound Organooxygen compound Oxacycle Vinylogous ester logp 0.43 ALOGPS logs 0.03 ALOGPS solubility 1.52e+02 g/l ALOGPS logp 0.32 ChemAxon pka_strongest_acidic 8.18 ChemAxon pka_strongest_basic -4.7 ChemAxon iupac 4-methoxy-2,5-dimethyl-2,3-dihydrofuran-3-one ChemAxon average_mass 142.1525 ChemAxon mono_mass 142.062994186 ChemAxon smiles COC1=C(C)OC(C)C1=O ChemAxon formula C7H10O3 ChemAxon inchi InChI=1S/C7H10O3/c1-4-6(8)7(9-3)5(2)10-4/h4H,1-3H3 ChemAxon inchikey SIMKGHMLPVDSJE-UHFFFAOYSA-N ChemAxon polar_surface_area 35.53 ChemAxon refractivity 38.04 ChemAxon polarizability 14.38 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 3 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 20526 Specdb::CMs 168862 Specdb::MsIr 6493 Specdb::MsIr 6494 Specdb::MsMs 6605 Specdb::MsMs 6606 Specdb::MsMs 6607 Specdb::MsMs 13277 Specdb::MsMs 13278 Specdb::MsMs 13279 Specdb::MsMs 2351959 Specdb::MsMs 2351960 Specdb::MsMs 2351961 Specdb::MsMs 2583035 Specdb::MsMs 2583036 Specdb::MsMs 2583037 HMDB34230 #<Reference:0x000055ce3362df98> Fruits Unknown generic caramel fruity grape maple mildew moldy mossy mushroom potato sweet