1.0 2010-04-08 22:06:14 UTC 2025-11-18 22:56:17 UTC FDB004433 6,10-Dimethylundecan-2-one 6,10-dimethylundecan-2-one is a member of the class of compounds known as ketones. Ketones 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. 6,10-dimethylundecan-2-one is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). 6,10-dimethylundecan-2-one can be found in tea, which makes 6,10-dimethylundecan-2-one a potential biomarker for the consumption of this food product. (1)-6,10-Dimethylundecan-2-one 2-Undecanone, 6,10-dimethyl- 6,10-Dimethyl-2-undecanone 6,10-Dimethylundecan-2-one Hexahydropseudoionone Pseudoionone, hexahydro- Tetrahydrogeranylacetone C13H26O 198.3449 198.198365454 6,10-dimethylundecan-2-one 6,10-dimethylundecan-2-one CC(C)CCCC(C)CCCC(C)=O InChI=1S/C13H26O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h11-12H,5-10H2,1-4H3 RBGLEUBCAJNCTR-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 logp 4.96 ALOGPS logs -5.26 ALOGPS solubility 1.08e-03 g/l ALOGPS logp 4.49 ChemAxon pka_strongest_acidic 19.64 ChemAxon pka_strongest_basic -7.3 ChemAxon iupac 6,10-dimethylundecan-2-one ChemAxon average_mass 198.3449 ChemAxon mono_mass 198.198365454 ChemAxon smiles CC(C)CCCC(C)CCCC(C)=O ChemAxon formula C13H26O ChemAxon inchi InChI=1S/C13H26O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h11-12H,5-10H2,1-4H3 ChemAxon inchikey RBGLEUBCAJNCTR-UHFFFAOYSA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 62.13 ChemAxon polarizability 26.15 ChemAxon rotatable_bond_count 8 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 62391 Specdb::MsMs 62392 Specdb::MsMs 62393 Specdb::MsMs 119103 Specdb::MsMs 119104 Specdb::MsMs 119105 Specdb::CMs 34487 Black tea Type 1 Green tea Type 1 Herbal tea Type 1 Red tea Type 1 Tea Type 1 specific Camellia sinensis 4442