1.0 2010-04-08 22:10:10 UTC 2019-11-26 03:06:45 UTC FDB012424 2-Tridecanone Isolated from plant oils, e.g. palm oil, coconut oiland is also found in American cranberry, rabbiteye, blueberry, raspberry, grapefruit, onion, ginger and cheeses. It is used as a flavouring essence. 2-Tridecankje Ammonium palmitate FEMA 3388 Hendecyl methyl ketone Mathyl undecyl kepoje Methyl n-undecyl ketone Methyl undecyl ketone NSC 14763 Tridecan-2-one Tridecanone Tridecanone-2 C13H26O 198.3449 198.198365454 tridecan-2-one 2-tridecanone 593-08-8 CCCCCCCCCCCC(C)=O InChI=1S/C13H26O/c1-3-4-5-6-7-8-9-10-11-12-13(2)14/h3-12H2,1-2H3 CYIFVRUOHKNECG-UHFFFAOYSA-N belongs to the class of organic compounds known as ketones. These are organic compounds in which a carbonyl group is bonded to two carbon atoms R2C=O (neither R may be a hydrogen atom). Ketones that have one or more alpha-hydrogen atoms undergo keto-enol tautomerization, the tautomer being an enol. Ketones Organic compounds Organic oxygen compounds Organooxygen compounds Carbonyl compounds Aliphatic acyclic compounds Hydrocarbon derivatives Organic oxides Aliphatic acyclic compound Hydrocarbon derivative Ketone Organic oxide Oxygenated hydrocarbons a ketone methyl ketone logp 5.22 ALOGPS logs -5.39 ALOGPS solubility 8.17e-04 g/l ALOGPS melting_point Mp 29° logp 4.81 ChemAxon pka_strongest_acidic 19.64 ChemAxon pka_strongest_basic -7.3 ChemAxon iupac tridecan-2-one ChemAxon average_mass 198.3449 ChemAxon mono_mass 198.198365454 ChemAxon smiles CCCCCCCCCCCC(C)=O ChemAxon formula C13H26O ChemAxon inchi InChI=1S/C13H26O/c1-3-4-5-6-7-8-9-10-11-12-13(2)14/h3-12H2,1-2H3 ChemAxon inchikey CYIFVRUOHKNECG-UHFFFAOYSA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 62.23 ChemAxon polarizability 26.9 ChemAxon rotatable_bond_count 10 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 13570 Specdb::CMs 28604 Specdb::CMs 101526 Specdb::CMs 132552 Specdb::CMs 140286 Specdb::MsIr 6424 Specdb::MsIr 6425 Specdb::MsMs 69255 Specdb::MsMs 69256 Specdb::MsMs 69257 Specdb::MsMs 127488 Specdb::MsMs 127489 Specdb::MsMs 127490 Specdb::MsMs 2280241 Specdb::MsMs 2280242 Specdb::MsMs 2280243 Specdb::MsMs 3089407 Specdb::MsMs 3089408 Specdb::MsMs 3089409 HMDB34148 #<Reference:0x000055ce32218850> Blackberry Type 1 specific Rubus Citrus Unknown generic Evergreen blackberry Type 1 specific Rubus laciniatus Fats and oils Unknown generic Fruits Unknown generic Garden onion Type 1 specific Allium cepa 4679 Garden onion (var.) Type 1 specific Allium cepa var. cepa 4679 Garden tomato (var.) Type 1 specific Solanum lycopersicum var. lycopersicum 397755 Green onion Type 1 Herbs and Spices Unknown generic Milk and milk products Unknown generic Onion-family vegetables Unknown generic Red onion Type 1 Welsh onion Type 1 specific Allium fistulosum 35875 coconut dairy earthy fatty herbal milky nutty waxy