1.0 2010-04-08 22:05:59 UTC 2025-11-18 22:54:11 UTC FDB003865 Phellandrene Phellandrene is the name for a pair of organic compounds that have a similar molecular structure and similar chemical properties. alpha-Phellandrene and beta-phellandrene are cyclic monoterpenes and are double-bond isomers. The phellandrenes are used in fragrances because of their pleasing aromas. Phellandrene is found in many foods, some of which are ceylon cinnamon, peppermint, anise, and dill. C10H16 136.238 136.125200515 2-methyl-5-(propan-2-yl)cyclohexa-1,3-diene (+-)-α phellandrene 99-83-2 CC(C)C1CC=C(C)C=C1 InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4-6,8,10H,7H2,1-3H3 OGLDWXZKYODSOB-UHFFFAOYSA-N belongs to the class of organic compounds known as menthane monoterpenoids. These are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes. Menthane monoterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Monoterpenoids Aliphatic homomonocyclic compounds Branched unsaturated hydrocarbons Cyclic olefins Monocyclic monoterpenoids Unsaturated aliphatic hydrocarbons Aliphatic homomonocyclic compound Branched unsaturated hydrocarbon Cyclic olefin Hydrocarbon Monocyclic monoterpenoid Olefin P-menthane monoterpenoid Unsaturated aliphatic hydrocarbon Unsaturated hydrocarbon a sesquiterpenoid phellandrene logp 4.29 ALOGPS logs -3.01 ALOGPS solubility 1.33e-01 g/l ALOGPS logp 3.21 ChemAxon iupac 2-methyl-5-(propan-2-yl)cyclohexa-1,3-diene ChemAxon average_mass 136.238 ChemAxon mono_mass 136.125200515 ChemAxon smiles CC(C)C1CC=C(C)C=C1 ChemAxon formula C10H16 ChemAxon inchi InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4-6,8,10H,7H2,1-3H3 ChemAxon inchikey OGLDWXZKYODSOB-UHFFFAOYSA-N ChemAxon polar_surface_area 0 ChemAxon refractivity 47.82 ChemAxon polarizability 17.14 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 0 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 5882 Specdb::CMs 28651 Specdb::CMs 28762 Specdb::CMs 101771 Specdb::CMs 101772 Specdb::CMs 103750 Specdb::CMs 131449 Specdb::CMs 139183 Specdb::MsMs 85596 Specdb::MsMs 85597 Specdb::MsMs 85598 Specdb::MsMs 147726 Specdb::MsMs 147727 Specdb::MsMs 147728 Specdb::MsMs 2846825 Specdb::MsMs 2846826 Specdb::MsMs 2846827 Specdb::MsMs 2862897 Specdb::MsMs 2862898 Specdb::MsMs 2862899 HMDB0035850 50034 Anise Type 1 specific Pimpinella anisum 271192 40.8 40.8 40.8 mg/100 g Ceylon cinnamon Type 1 specific Cinnamomum verum 128608 15.75 15.75 15.75 mg/100 g Common sage Type 1 specific Salvia officinalis 38868 33.0 33.0 33.0 mg/100 g Dill Type 1 specific Anethum graveolens 40922 Fennel Type 1 specific Foeniculum vulgare 48038 Peppermint Type 1 specific Mentha X piperita 34256 1.1 1.1 1.1 mg/100 g Sweet basil Type 1 specific Ocimum basilicum 39350 Sweet bay Type 1 specific Laurus nobilis 85223 Tarragon Type 1 specific Artemisia dracunculus 72341 mint spice turpentine Hyperthermic 1008 Irritant 1055 Spasmogenic 1320 Tumor promoter 1387 A role played by a chemical compound which is known to induce a process of carcinogenesis by corrupting normal cellular pathways, leading to the acquistion of tumoral capabilities.