1.0 2010-04-08 22:09:29 UTC 2025-11-18 23:24:46 UTC FDB011128 2-Acetylfuran Present in cooked apple, morello cherry, wine grapes, peach, strawberry, plum, rabbiteye blueberry, asparagus, kohlrabi, baked potato, pineapple, bread products, rice, yoghurt, wines, soybean, black tea and calamus (European origin). Contributes to aroma of many foods and beverages. It is used in flavour compositions. 2-Acetylfuran is found in many foods, some of which are orange bell pepper, brassicas, pepper (c. annuum), and fruits. (2-furanyl)-1-ethanone 1-(2-Furanyl)-ethanone 1-(2-Furanyl)-ethanone (2-acetylfuran) 1-(2-Furanyl)ethanone 1-(2-furanyl)ethanone (acetylfuran) 1-(2-Furanyl)ethanone, 9CI 1-(2-Furyl)ethanone 1-(furan-2-yl)ethanone 2-Acetofurone 2-Acetyl-furan 2-Acetylfurane 2-Furyl methyl ketone 2-Furylethanone a-Furyl methyl ketone Acetylfuran Ethanone, 1-(2-furanyl)- FEMA 3163 Furan, 2-acetyl- Furyl methyl ketone Ketone, 2-furyl methyl Methyl 2-furyl ketone C6H6O2 110.1106 110.036779436 1-(furan-2-yl)ethan-1-one acetylfuran 1192-62-7 CC(=O)C1=CC=CO1 InChI=1S/C6H6O2/c1-5(7)6-3-2-4-8-6/h2-4H,1H3 IEMMBWWQXVXBEU-UHFFFAOYSA-N belongs to the class of organic compounds known as aryl alkyl ketones. These are ketones have the generic structure RC(=O)R', where R = aryl group and R'=alkyl group. Aryl alkyl ketones Organic compounds Organic oxygen compounds Organooxygen compounds Carbonyl compounds Aromatic heteromonocyclic compounds Furans Heteroaromatic compounds Hydrocarbon derivatives Organic oxides Oxacyclic compounds Aromatic heteromonocyclic compound Aryl alkyl ketone Furan Heteroaromatic compound Hydrocarbon derivative Organic oxide Organoheterocyclic compound Oxacycle aromatic ketone furans methyl ketone logp 0.73 ALOGPS logs -0.76 ALOGPS solubility 1.91e+01 g/l ALOGPS melting_point Mp 33° logp 0.59 ChemAxon pka_strongest_acidic 14.37 ChemAxon pka_strongest_basic -3 ChemAxon iupac 1-(furan-2-yl)ethan-1-one ChemAxon average_mass 110.1106 ChemAxon mono_mass 110.036779436 ChemAxon smiles CC(=O)C1=CC=CO1 ChemAxon formula C6H6O2 ChemAxon inchi InChI=1S/C6H6O2/c1-5(7)6-3-2-4-8-6/h2-4H,1H3 ChemAxon inchikey IEMMBWWQXVXBEU-UHFFFAOYSA-N ChemAxon polar_surface_area 30.21 ChemAxon refractivity 28.85 ChemAxon polarizability 10.9 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::EiMs 1643 Specdb::MsIr 5970 Specdb::MsIr 5971 Specdb::CMs 3338 Specdb::CMs 28538 Specdb::CMs 28888 Specdb::CMs 101303 Specdb::CMs 101304 Specdb::CMs 133339 Specdb::CMs 141073 Specdb::NmrOneD 3815 Specdb::NmrOneD 4080 Specdb::NmrOneD 118198 Specdb::NmrOneD 118199 Specdb::NmrOneD 118200 Specdb::NmrOneD 118201 Specdb::NmrOneD 118202 Specdb::NmrOneD 118203 Specdb::NmrOneD 118204 Specdb::NmrOneD 118205 Specdb::NmrOneD 118206 Specdb::NmrOneD 118207 Specdb::NmrOneD 118208 Specdb::NmrOneD 118209 Specdb::NmrOneD 118210 Specdb::NmrOneD 118211 Specdb::NmrOneD 118212 Specdb::NmrOneD 118213 Specdb::NmrOneD 118214 Specdb::NmrOneD 118215 Specdb::NmrOneD 118216 Specdb::NmrOneD 118217 Specdb::MsMs 105156 Specdb::MsMs 105157 Specdb::MsMs 105158 Specdb::MsMs 171600 Specdb::MsMs 171601 Specdb::MsMs 171602 Specdb::MsMs 2400459 Specdb::MsMs 2400460 Specdb::MsMs 2400461 Specdb::MsMs 2539163 Specdb::MsMs 2539164 Specdb::MsMs 2539165 HMDB33127 #<Reference:0x000055ce3209e7b8> Alcoholic beverages Unknown generic Black tea Type 1 Blackberry Type 1 specific Rubus Brassicas Unknown generic 3705 Breakfast cereal Type 2 specific Cauliflower Type 1 specific Brassica oleracea var. botrytis 3715 Cereals and cereal products Unknown generic Corn Type 1 specific Zea mays 4577 0.0 0.0 0.0 mg/100 g Evergreen blackberry Type 1 specific Rubus laciniatus Fruits Unknown generic Green bell pepper Type 1 specific Capsicum annuum 4072 Green tea Type 1 Green vegetables Unknown generic Guava Type 1 specific Psidium guajava 120290 Herbal tea Type 1 Kohlrabi Type 1 specific Brassica oleracea var. gongylodes 109379 0.002 0.002 0.002 mg/100 g Orange bell pepper Type 1 specific Capsicum annuum 4072 Pepper Type 1 specific Capsicum annuum 4072 Pomes Unknown generic Potato Type 1 specific Solanum tuberosum 4113 Red bell pepper Type 1 specific Capsicum annuum 4072 Red tea Type 1 Sesame Type 1 specific Sesamum orientale 4182 Tamarind Type 1 specific Tamarindus indica 58860 Tea Type 1 specific Camellia sinensis 4442 Tortilla Type 2 specific 0.0 0.0 0.0 mg/100 g Tortilla chip Type 2 specific White mustard Type 1 specific Sinapis alba 3728 Yellow bell pepper Type 1 specific Capsicum annuum 4072 almond balsam balsamic beef caramel cocoa coffee peanut potato sweet tobacco