1.02010-04-08 22:06:02 UTC2019-11-26 02:59:44 UTCFDB004001trans-p-Mentha-1(7),8-dien-2-olTrans-p-mentha-1(7),8-dien-2-ol is a member of the class of compounds known as menthane monoterpenoids. Menthane monoterpenoids 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. Trans-p-mentha-1(7),8-dien-2-ol is slightly soluble (in water) and an extremely weak acidic compound (based on its pKa). Trans-p-mentha-1(7),8-dien-2-ol can be found in wild celery, which makes trans-p-mentha-1(7),8-dien-2-ol a potential biomarker for the consumption of this food product. Cyclohexanol, 2-methylene-5-(1-methylethenyl)-, (1S-cis)-p-Mentha-1(7),8-dien-2-ol, transtrans-1(7),8-p-Menthadien-2-oltrans-Mentha-1(7),8-dien-2-oltrans-p-Menth-1(7),8-dien-2-oltrans-p-Mentha-1(7), 8-dien-2-oltrans-p-Mentha-1(7),8-diene-2-olC10H16O152.237152.120115135(1S,5S)-2-methylidene-5-(prop-1-en-2-yl)cyclohexan-1-ol(1S,5S)-2-methylidene-5-(prop-1-en-2-yl)cyclohexan-1-ol147-85-3[H][C@]1(O)C[C@]([H])(CCC1=C)C(C)=CInChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(11)6-9/h9-11H,1,3-6H2,2H3/t9-,10-/m0/s1PNVTXOFNJFHXOK-UWVGGRQHSA-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 monoterpenoidsOrganic compoundsLipids and lipid-like moleculesPrenol lipidsMonoterpenoidsAliphatic homomonocyclic compoundsCyclic alcohols and derivativesHydrocarbon derivativesMonocyclic monoterpenoidsSecondary alcoholsAlcoholAliphatic homomonocyclic compoundCyclic alcoholHydrocarbon derivativeMonocyclic monoterpenoidOrganic oxygen compoundOrganooxygen compoundP-menthane monoterpenoidSecondary alcohollogp2.47logs-1.95solubility1.71e+00 g/llogp2.05pka_strongest_acidic18.21pka_strongest_basic-1.4iupac(1S,5S)-2-methylidene-5-(prop-1-en-2-yl)cyclohexan-1-olaverage_mass152.237mono_mass152.120115135smiles[H][C@]1(O)C[C@]([H])(CCC1=C)C(C)=CformulaC10H16OinchiInChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(11)6-9/h9-11H,1,3-6H2,2H3/t9-,10-/m0/s1inchikeyPNVTXOFNJFHXOK-UWVGGRQHSA-Npolar_surface_area20.23refractivity46.92polarizability18.2rotatable_bond_count1acceptor_count1donor_count1physiological_charge0formal_charge0Specdb::MsMs101112Specdb::MsMs101113Specdb::MsMs101114Specdb::MsMs166647Specdb::MsMs166648Specdb::MsMs166649Specdb::MsMs3599759Specdb::MsMs3599760Specdb::MsMs3599761Specdb::MsMs3599762Specdb::MsMs3599763Specdb::MsMs3599764Wild celeryType 1specificApium graveolens4045