1.0 2010-04-08 22:13:40 UTC 2025-11-19 02:11:01 UTC FDB018355 3,6-Dimethyl-2(3H)-benzofuranone It is used as a food additive FEMA 3863 Furaminton C10H10O2 162.1852 162.068079564 3,6-dimethyl-2,3-dihydro-1-benzofuran-2-one 3,6-dimethyl-3H-1-benzofuran-2-one 65817-24-5 CC1C(=O)OC2=C1C=CC(C)=C2 InChI=1S/C10H10O2/c1-6-3-4-8-7(2)10(11)12-9(8)5-6/h3-5,7H,1-2H3 JSJKAEKKWQOCEZ-UHFFFAOYSA-N belongs to the class of organic compounds known as benzofurans. These are organic compounds containing a benzene ring fused to a furan. Furan is a five-membered aromatic ring with four carbon atoms and one oxygen atom. Benzofurans Organic compounds Organoheterocyclic compounds Benzofurans Aromatic heteropolycyclic compounds Benzenoids Carbonyl compounds Carboxylic acid esters Coumarans Hydrocarbon derivatives Lactones Monocarboxylic acids and derivatives Organic oxides Oxacyclic compounds Aromatic heteropolycyclic compound Benzenoid Benzofuran Carbonyl group Carboxylic acid derivative Carboxylic acid ester Coumaran Hydrocarbon derivative Lactone Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound Oxacycle logp 2.58 ALOGPS logs -2.40 ALOGPS solubility 6.51e-01 g/l ALOGPS logp 2.5 ChemAxon pka_strongest_acidic 11.89 ChemAxon pka_strongest_basic -7.3 ChemAxon iupac 3,6-dimethyl-2,3-dihydro-1-benzofuran-2-one ChemAxon average_mass 162.1852 ChemAxon mono_mass 162.068079564 ChemAxon smiles CC1C(=O)OC2=C1C=CC(C)=C2 ChemAxon formula C10H10O2 ChemAxon inchi InChI=1S/C10H10O2/c1-6-3-4-8-7(2)10(11)12-9(8)5-6/h3-5,7H,1-2H3 ChemAxon inchikey JSJKAEKKWQOCEZ-UHFFFAOYSA-N ChemAxon polar_surface_area 26.3 ChemAxon refractivity 45.47 ChemAxon polarizability 17.36 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 13920 Specdb::CMs 159542 Specdb::MsIr 8043 Specdb::MsIr 8044 Specdb::MsMs 63765 Specdb::MsMs 63766 Specdb::MsMs 63767 Specdb::MsMs 120765 Specdb::MsMs 120766 Specdb::MsMs 120767 Specdb::MsMs 2436067 Specdb::MsMs 2436068 Specdb::MsMs 2436069 Specdb::MsMs 2526117 Specdb::MsMs 2526118 Specdb::MsMs 2526119 HMDB0038893 coconut