1.0 2010-04-08 22:13:47 UTC 2025-11-19 02:12:11 UTC FDB018551 (1alpha,2alpha,4betaH,6alpha,8R)-p-Menthane-2,6,8,9-tetrol Constituent of fruit of Carum carvi (caraway). (1alpha,2alpha,4betaH,6alpha,8R)-p-Menthane-2,6,8,9-tetrol is found in herbs and spices. C10H20O4 204.2634 204.136159128 5-(1,2-dihydroxypropan-2-yl)-2-methylcyclohexane-1,3-diol 5-(1,2-dihydroxypropan-2-yl)-2-methylcyclohexane-1,3-diol 402593-44-6 CC1C(O)CC(CC1O)C(C)(O)CO InChI=1S/C10H20O4/c1-6-8(12)3-7(4-9(6)13)10(2,14)5-11/h6-9,11-14H,3-5H2,1-2H3 NKYSPMJOKCOMFJ-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 Cyclic alcohols and derivatives Cyclohexanols Hydrocarbon derivatives Monocyclic monoterpenoids Primary alcohols Tertiary alcohols Alcohol Aliphatic homomonocyclic compound Cyclic alcohol Cyclohexanol Hydrocarbon derivative Monocyclic monoterpenoid Organic oxygen compound Organooxygen compound P-menthane monoterpenoid Primary alcohol Secondary alcohol Tertiary alcohol logp -0.41 ALOGPS logs -0.18 ALOGPS solubility 1.36e+02 g/l ALOGPS logp -1.1 ChemAxon pka_strongest_acidic 13.79 ChemAxon pka_strongest_basic -2.9 ChemAxon iupac 5-(1,2-dihydroxypropan-2-yl)-2-methylcyclohexane-1,3-diol ChemAxon average_mass 204.2634 ChemAxon mono_mass 204.136159128 ChemAxon smiles CC1C(O)CC(CC1O)C(C)(O)CO ChemAxon formula C10H20O4 ChemAxon inchi InChI=1S/C10H20O4/c1-6-8(12)3-7(4-9(6)13)10(2,14)5-11/h6-9,11-14H,3-5H2,1-2H3 ChemAxon inchikey NKYSPMJOKCOMFJ-UHFFFAOYSA-N ChemAxon polar_surface_area 80.92 ChemAxon refractivity 52.32 ChemAxon polarizability 22.15 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 4 ChemAxon donor_count 4 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 13854 Specdb::CMs 46232 Specdb::CMs 135367 Specdb::CMs 143101 Specdb::MsMs 79266 Specdb::MsMs 79267 Specdb::MsMs 79268 Specdb::MsMs 139815 Specdb::MsMs 139816 Specdb::MsMs 139817 Specdb::MsMs 2345903 Specdb::MsMs 2345904 Specdb::MsMs 2345905 Specdb::MsMs 2592310 Specdb::MsMs 2592311 Specdb::MsMs 2592312 Specdb::NmrOneD 30882 Specdb::NmrOneD 30883 Specdb::NmrOneD 30884 Specdb::NmrOneD 30885 Specdb::NmrOneD 30886 Specdb::NmrOneD 30887 Specdb::NmrOneD 30888 Specdb::NmrOneD 30889 Specdb::NmrOneD 30890 Specdb::NmrOneD 30891 Specdb::NmrOneD 30892 Specdb::NmrOneD 30893 Specdb::NmrOneD 30894 Specdb::NmrOneD 30895 Specdb::NmrOneD 30896 Specdb::NmrOneD 30897 Specdb::NmrOneD 30898 Specdb::NmrOneD 30899 Specdb::NmrOneD 30900 Specdb::NmrOneD 30901 HMDB39053 #<Reference:0x000055ce317c2310> Herbs and Spices Unknown generic