1.0 2010-04-08 22:14:44 UTC 2019-11-26 03:18:17 UTC FDB020005 1,2-Dihydro-1,1,6-trimethylnaphthalene Isolated from strawberry oil, peaches, tobacco and wines. Component of wine off-flavour on ageing. 1,2-Dihydro-1,1,6-trimethylnaphthalene is found in alcoholic beverages and fruits. 1,1,6-Trimethyl-1,2-dihydro-naphthalene 1,1,6-Trimethyl-1,2-dihydronaphthalene 1,1,6-Trimethyl-2H-naphthalene 1,2-Dihydro-1,5,8-trimethylnaphthalene 1,5,8-Trimethyl-1,2-dihydronaphthalene 3,4-Dehydroionene Dehydro-AR-ionene Napthalene,1,2,diydro-1,1,6-trimethyl TDN C13H16 172.2661 172.125200512 1,1,6-trimethyl-1,2-dihydronaphthalene 1,1,6-trimethyl-2H-naphthalene 30364-38-6 CC1=CC2=C(C=C1)C(C)(C)CC=C2 InChI=1S/C13H16/c1-10-6-7-12-11(9-10)5-4-8-13(12,2)3/h4-7,9H,8H2,1-3H3 RTUMCNDCAVLXEP-UHFFFAOYSA-N belongs to the class of organic compounds known as naphthalenes. Naphthalenes are compounds containing a naphthalene moiety, which consists of two fused benzene rings. Naphthalenes Organic compounds Benzenoids Naphthalenes Aromatic homopolycyclic compounds Aromatic hydrocarbons Cyclic olefins Polycyclic hydrocarbons Aromatic homopolycyclic compound Aromatic hydrocarbon Cyclic olefin Hydrocarbon Naphthalene Olefin Polycyclic hydrocarbon Unsaturated hydrocarbon logp 4.96 ALOGPS logs -4.89 ALOGPS solubility 2.22e-03 g/l ALOGPS logp 4.25 ChemAxon iupac 1,1,6-trimethyl-1,2-dihydronaphthalene ChemAxon average_mass 172.2661 ChemAxon mono_mass 172.125200512 ChemAxon smiles CC1=CC2=C(C=C1)C(C)(C)CC=C2 ChemAxon formula C13H16 ChemAxon inchi InChI=1S/C13H16/c1-10-6-7-12-11(9-10)5-4-8-13(12,2)3/h4-7,9H,8H2,1-3H3 ChemAxon inchikey RTUMCNDCAVLXEP-UHFFFAOYSA-N ChemAxon polar_surface_area 0 ChemAxon refractivity 58.72 ChemAxon polarizability 21.23 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 0 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 2630 Specdb::CMs 145988 Specdb::MsMs 7151 Specdb::MsMs 7152 Specdb::MsMs 7153 Specdb::MsMs 13823 Specdb::MsMs 13824 Specdb::MsMs 13825 Specdb::MsMs 2462266 Specdb::MsMs 2462267 Specdb::MsMs 2462268 Specdb::MsMs 2500223 Specdb::MsMs 2500224 Specdb::MsMs 2500225 Specdb::NmrOneD 338868 Specdb::NmrOneD 338869 Specdb::NmrOneD 338870 Specdb::NmrOneD 338871 Specdb::NmrOneD 338872 Specdb::NmrOneD 338873 Specdb::NmrOneD 338874 Specdb::NmrOneD 338875 Specdb::NmrOneD 338876 Specdb::NmrOneD 338877 Specdb::NmrOneD 338878 Specdb::NmrOneD 338879 Specdb::NmrOneD 338880 Specdb::NmrOneD 338881 Specdb::NmrOneD 338882 Specdb::NmrOneD 338883 Specdb::NmrOneD 338884 Specdb::NmrOneD 338885 Specdb::NmrOneD 338886 Specdb::NmrOneD 338887 HMDB40284 #<Reference:0x000055ce3159e390> Alcoholic beverages Unknown generic Fruits Unknown generic licorice