1.0 2010-04-08 22:04:42 UTC 2020-09-17 15:31:00 UTC FDB000757 Nonane Nonane, also known as n-Nonane or CH3-[CH2]7-CH3, is a straight-chain alkane with 9 carbon atoms. It belongs to the class of organic compounds known as alkanes. They are acyclic branched or unbranched hydrocarbons having the general formula CnH2n+2, and consist entirely of hydrogen atoms and saturated carbon atoms. Nonane is a hydrocarbon lipid molecule that is very hydrophobic, practically insoluble in water and relatively neutral. It has a gasoline odor ( http://www.thegoodscentscompany.com/data/rw1269671.html#toorgano). Nonane can be found in higher concentrations in limes and common oregano. Nonane has also been detected in celeriac, sweet bay, sweet cherries, gingers, and garden tomato (http://www.thegoodscentscompany.com/data/rw1269671.html#tooccur). CH3-[CH2]7-CH3 N-nonane Nonan C9H20 128.2551 128.15650064 nonane nonane 111-84-2 CCCCCCCCC InChI=1S/C9H20/c1-3-5-7-9-8-6-4-2/h3-9H2,1-2H3 BKIMMITUMNQMOS-UHFFFAOYSA-N belongs to the class of organic compounds known as alkanes. These are acyclic branched or unbranched hydrocarbons having the general formula CnH2n+2 , and therefore consisting entirely of hydrogen atoms and saturated carbon atoms. Alkanes Organic compounds Hydrocarbons Saturated hydrocarbons Alkanes Aliphatic acyclic compounds Acyclic alkane Aliphatic acyclic compound Alkane Hydrocarbons a small molecule alkane Liquid logp 5.24 ALOGPS logs -5.04 ALOGPS solubility 1.17e-03 g/l ALOGPS melting_point Fp -51° logp 4.46 ChemAxon iupac nonane ChemAxon average_mass 128.2551 ChemAxon mono_mass 128.15650064 ChemAxon smiles CCCCCCCCC ChemAxon formula C9H20 ChemAxon inchi InChI=1S/C9H20/c1-3-5-7-9-8-6-4-2/h3-9H2,1-2H3 ChemAxon inchikey BKIMMITUMNQMOS-UHFFFAOYSA-N ChemAxon polar_surface_area 0 ChemAxon refractivity 43.21 ChemAxon polarizability 18.5 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 0 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 21931 Specdb::CMs 28487 Specdb::CMs 29954 Specdb::CMs 100341 Specdb::CMs 100342 Specdb::CMs 134980 Specdb::CMs 142714 Specdb::MsMs 52173 Specdb::MsMs 52174 Specdb::MsMs 52175 Specdb::MsMs 140235 Specdb::MsMs 140236 Specdb::MsMs 140237 Specdb::MsMs 2457809 Specdb::MsMs 2457810 Specdb::MsMs 2457811 Specdb::MsMs 2480527 Specdb::MsMs 2480528 Specdb::MsMs 2480529 HMDB29595 32892 DD9 #<Reference:0x000055ce31ec2c78> Cauliflower Type 1 specific Brassica oleracea var. botrytis 3715 Celeriac Type 1 specific Apium graveolens var. rapaceum 278110 Celery stalks Type 1 specific Apium graveolens var. dulce 117781 Common oregano Type 1 specific Origanum vulgare 39352 0.1 0.1 0.1 mg/100 g Corn Type 1 specific Zea mays 4577 Fats and oils Unknown generic Garden tomato (var.) Type 1 specific Solanum lycopersicum var. lycopersicum 397755 Ginger Type 1 specific Zingiber officinale 94328 Lime Type 1 specific Citrus aurantiifolia 159033 0.6 0.6 0.6 mg/100 g Pepper (Spice) Type 1 specific Piper nigrum 13216 Sweet bay Type 1 specific Laurus nobilis 85223 Sweet cherry Type 1 specific Prunus avium 42229 alkane gasoline