1.0 2011-10-02 06:38:07 UTC 2025-11-19 02:59:06 UTC FDB029791 6-Acetyl-1,1,2,4,4,7-hexamethyltetralin Flavouring compound [Superscent] C18H26O 258.3984 258.198365454 1-(3,5,5,6,8,8-hexamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one tonalid CC1CC(C)(C)C2=C(C=C(C)C(=C2)C(C)=O)C1(C)C InChI=1S/C18H26O/c1-11-8-16-15(9-14(11)13(3)19)17(4,5)10-12(2)18(16,6)7/h8-9,12H,10H2,1-7H3 DNRJTBAOUJJKDY-UHFFFAOYSA-N belongs to the class of organic compounds known as tetralins. These are polycyclic aromatic compounds containing a tetralin moiety, which consists of a benzene fused to a cyclohexane. Tetralins Organic compounds Benzenoids Tetralins Aromatic homopolycyclic compounds Acetophenones Aryl alkyl ketones Hydrocarbon derivatives Organic oxides Acetophenone Aromatic homopolycyclic compound Aryl alkyl ketone Aryl ketone Hydrocarbon derivative Ketone Organic oxide Organic oxygen compound Organooxygen compound Tetralin logp 5.70 ALOGPS logs -5.60 ALOGPS solubility 6.54e-04 g/l ALOGPS logp 4.96 ChemAxon pka_strongest_acidic 16.3 ChemAxon pka_strongest_basic -7.4 ChemAxon iupac 1-(3,5,5,6,8,8-hexamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one ChemAxon average_mass 258.3984 ChemAxon mono_mass 258.198365454 ChemAxon smiles CC1CC(C)(C)C2=C(C=C(C)C(=C2)C(C)=O)C1(C)C ChemAxon formula C18H26O ChemAxon inchi InChI=1S/C18H26O/c1-11-8-16-15(9-14(11)13(3)19)17(4,5)10-12(2)18(16,6)7/h8-9,12H,10H2,1-7H3 ChemAxon inchikey DNRJTBAOUJJKDY-UHFFFAOYSA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 81.58 ChemAxon polarizability 31.82 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 35235 Specdb::CMs 122608 Specdb::CMs 134844 Specdb::CMs 142578 Specdb::MsMs 48840 Specdb::MsMs 48841 Specdb::MsMs 48842 Specdb::MsMs 128610 Specdb::MsMs 128611 Specdb::MsMs 128612 Specdb::MsMs 2236570 Specdb::MsMs 2238726 Specdb::MsMs 2238871 Specdb::MsMs 2240830 Specdb::MsMs 2240854 Specdb::MsMs 2242886 Specdb::MsMs 2242970 Specdb::MsMs 2784325 Specdb::MsMs 2784326 Specdb::MsMs 2784327 Specdb::MsMs 2921116 Specdb::MsMs 2921117 Specdb::MsMs 2921118 HMDB0061860 musky