1.0 2011-06-09 23:28:35 UTC 2019-11-26 03:20:59 UTC FDB021861 (+)-beta-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. (+)-beta-Phellandrene is found in ginger. (+)-b-Phellandrene (+)-beta-Phellandrene (+)-p-Mentha-1(7),2-diene (+)-β-phellandrene (4S)-p-Mentha-1(7),2-diene (6S)-3-Methylidene-6-(propan-2-yl)cyclohex-1-ene (S)-3-Isopropyl-6-methylenecyclohexene (S)-p-Mentha-1(7),2-diene D-beta-Phellandrene C10H16 136.234 136.125200512 (6S)-3-methylidene-6-(propan-2-yl)cyclohex-1-ene (+)-β-phellandrene 6153-16-8 [H][C@]1(CCC(=C)C=C1)C(C)C InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,6,8,10H,3,5,7H2,1-2H3/t10-/m0/s1 LFJQCDVYDGGFCH-JTQLQIEISA-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 Cycloalkenes Monocyclic monoterpenoids Unsaturated aliphatic hydrocarbons Aliphatic homomonocyclic compound Branched unsaturated hydrocarbon Cyclic olefin Cycloalkene Hydrocarbon Monocyclic monoterpenoid Olefin P-menthane monoterpenoid Unsaturated aliphatic hydrocarbon Unsaturated hydrocarbon Cyclic monoterpenes Menthane monoterpenoids Menthane monoterpenoids beta-phellandrene Liquid logp 3.98 ALOGPS logs -3.60 ALOGPS solubility 3.44e-02 g/l ALOGPS melting_point Bp 171-172° logp 3.26 ChemAxon iupac (6S)-3-methylidene-6-(propan-2-yl)cyclohex-1-ene ChemAxon average_mass 136.234 ChemAxon mono_mass 136.125200512 ChemAxon smiles [H][C@]1(CCC(=C)C=C1)C(C)C ChemAxon formula C10H16 ChemAxon inchi InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,6,8,10H,3,5,7H2,1-2H3/t10-/m0/s1 ChemAxon inchikey LFJQCDVYDGGFCH-JTQLQIEISA-N ChemAxon polar_surface_area 0 ChemAxon refractivity 46.75 ChemAxon polarizability 17.22 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 0 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 11729 Specdb::CMs 161340 Specdb::EiMs 1851 Specdb::MsMs 64230 Specdb::MsMs 64231 Specdb::MsMs 64232 Specdb::MsMs 121335 Specdb::MsMs 121336 Specdb::MsMs 121337 Specdb::MsMs 2800282 Specdb::MsMs 2800283 Specdb::MsMs 2800284 Specdb::MsMs 2878400 Specdb::MsMs 2878401 Specdb::MsMs 2878402 HMDB41634 53 #<Reference:0x000055ce307d58d0> Ginger Type 1 specific Zingiber officinale 94328