1.0 2010-04-08 22:12:09 UTC 2019-11-26 03:12:29 UTC FDB015962 2,6-Dimethyl-3,7-octadiene-2,6-diol Detected in many fruits and aromatic oils and in wines. 2,6-Dimethyl-3,7-octadiene-2,6-diol is found in many foods, some of which are herbs and spices, papaya, fruits, and alcoholic beverages. (3E)-2,6-Dimethyl-3,7-octadiene-2,6-diol (E)-2,6-Dimethyl-3,7-octadien-2,6-diol 1,5-Octadien-3,7-diol, 3,7-dimethyl 1,5-Octadiene-3,7-diol, 3,7-dimethyl- 2,6-dimethyl-3,7-octadien-2,6-diol 2,6-Dimethylocta-3,7-dien-2,6-diol 2,6-dimethylocta-3,7-diene-2,6-diol 3,7-dimethyl-1,5-octadien-3,7-diol 3,7-Dimethyl-1,5-octadiene-3,7-diol 3,7-dimethyloct-1,5-dien-3,7-diol 3,7-dimethylocta-1,5-diene-3,7-diol 3,7-octadiene-2,6-diol, 2,6-dimethyl- trans-3,7-dimethyl-1,5-octadiene-3,7-diol C10H18O2 170.2487 170.13067982 (3E)-2,6-dimethylocta-3,7-diene-2,6-diol (3E)-2,6-dimethylocta-3,7-diene-2,6-diol 13741-21-4 CC(C)(O)\C=C\CC(C)(O)C=C InChI=1S/C10H18O2/c1-5-10(4,12)8-6-7-9(2,3)11/h5-7,11-12H,1,8H2,2-4H3/b7-6+ QEOHJVNDENHRCH-VOTSOKGWSA-N belongs to the class of organic compounds known as tertiary alcohols. Tertiary alcohols are compounds in which a hydroxy group, -OH, is attached to a saturated carbon atom R3COH (R not H ). Tertiary alcohols Organic compounds Organic oxygen compounds Organooxygen compounds Alcohols and polyols Aliphatic acyclic compounds Hydrocarbon derivatives Aliphatic acyclic compound Hydrocarbon derivative Tertiary alcohol logp 1.62 ALOGPS logs -1.87 ALOGPS solubility 2.32e+00 g/l ALOGPS logp 1.38 ChemAxon pka_strongest_acidic 17.78 ChemAxon pka_strongest_basic -1.2 ChemAxon iupac (3E)-2,6-dimethylocta-3,7-diene-2,6-diol ChemAxon average_mass 170.2487 ChemAxon mono_mass 170.13067982 ChemAxon smiles CC(C)(O)\C=C\CC(C)(O)C=C ChemAxon formula C10H18O2 ChemAxon inchi InChI=1S/C10H18O2/c1-5-10(4,12)8-6-7-9(2,3)11/h5-7,11-12H,1,8H2,2-4H3/b7-6+ ChemAxon inchikey QEOHJVNDENHRCH-VOTSOKGWSA-N ChemAxon polar_surface_area 40.46 ChemAxon refractivity 52.16 ChemAxon polarizability 20.01 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 2 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 7332 Specdb::MsIr 7333 Specdb::MsIr 7334 Specdb::MsMs 72771 Specdb::MsMs 72772 Specdb::MsMs 72773 Specdb::MsMs 131763 Specdb::MsMs 131764 Specdb::MsMs 131765 Specdb::MsMs 3037103 Specdb::MsMs 3037104 Specdb::MsMs 3037105 Specdb::MsMs 3106757 Specdb::MsMs 3106758 Specdb::MsMs 3106759 Specdb::CMs 2781 Specdb::CMs 45163 Specdb::CMs 160360 Specdb::NmrOneD 138030 Specdb::NmrOneD 138031 Specdb::NmrOneD 138032 Specdb::NmrOneD 138033 Specdb::NmrOneD 138034 Specdb::NmrOneD 138035 Specdb::NmrOneD 138036 Specdb::NmrOneD 138037 Specdb::NmrOneD 138038 Specdb::NmrOneD 138039 Specdb::NmrOneD 138040 Specdb::NmrOneD 138041 Specdb::NmrOneD 138042 Specdb::NmrOneD 138043 Specdb::NmrOneD 138044 Specdb::NmrOneD 138045 Specdb::NmrOneD 138046 Specdb::NmrOneD 138047 Specdb::NmrOneD 138048 Specdb::NmrOneD 138049 HMDB36990 #<Reference:0x000055ce32111880> Alcoholic beverages Unknown generic Fruits Unknown generic Herbs and Spices Unknown generic Papaya Type 1 specific Carica papaya 3649