1.0 2010-04-08 22:14:22 UTC 2019-11-26 03:17:31 UTC FDB019467 2-Hexylfuran Reported in roast chicken, roast lamb fat, roast peanut oil, roast guinea hen, fenugreek seed, cooked pork, coriander oil and used cooking fats. 2-Hexylfuran is found in many foods, some of which are fats and oils, animal foods, nuts, and herbs and spices. 2-Hexyl-furan 2-n-Hexylfuran Furan, 2-hexyl- C10H16O 152.2334 152.120115134 2-hexylfuran 2-hexylfuran 3777-70-6 CCCCCCC1=CC=CO1 InChI=1S/C10H16O/c1-2-3-4-5-7-10-8-6-9-11-10/h6,8-9H,2-5,7H2,1H3 XBLCAKKYMZVLPU-UHFFFAOYSA-N belongs to the class of organic compounds known as heteroaromatic compounds. Heteroaromatic compounds are compounds containing an aromatic ring where a carbon atom is linked to an hetero atom. Heteroaromatic compounds Organic compounds Organoheterocyclic compounds Heteroaromatic compounds Aromatic heteromonocyclic compounds Furans Hydrocarbon derivatives Organooxygen compounds Oxacyclic compounds Aromatic heteromonocyclic compound Furan Heteroaromatic compound Hydrocarbon derivative Organic oxygen compound Organooxygen compound Oxacycle logp 4.61 ALOGPS logs -3.58 ALOGPS solubility 4.02e-02 g/l ALOGPS logp 3.61 ChemAxon pka_strongest_basic -2.6 ChemAxon iupac 2-hexylfuran ChemAxon average_mass 152.2334 ChemAxon mono_mass 152.120115134 ChemAxon smiles CCCCCCC1=CC=CO1 ChemAxon formula C10H16O ChemAxon inchi InChI=1S/C10H16O/c1-2-3-4-5-7-10-8-6-9-11-10/h6,8-9H,2-5,7H2,1H3 ChemAxon inchikey XBLCAKKYMZVLPU-UHFFFAOYSA-N ChemAxon polar_surface_area 13.14 ChemAxon refractivity 46.65 ChemAxon polarizability 19.07 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 0 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 8356 Specdb::MsIr 8357 Specdb::CMs 9687 Specdb::CMs 28886 Specdb::CMs 102035 Specdb::CMs 134687 Specdb::CMs 142421 Specdb::MsMs 74721 Specdb::MsMs 74722 Specdb::MsMs 74723 Specdb::MsMs 134187 Specdb::MsMs 134188 Specdb::MsMs 134189 Specdb::MsMs 2461807 Specdb::MsMs 2461808 Specdb::MsMs 2461809 Specdb::MsMs 2499872 Specdb::MsMs 2499873 Specdb::MsMs 2499874 HMDB39816 #<Reference:0x000055ce31d62310> Fats and oils Unknown generic Herbs and Spices Unknown generic Nuts Unknown generic