1.0 2010-04-08 22:07:14 UTC 2025-11-18 23:02:27 UTC FDB006661 9,10-Cyclo-2,4-menthanediol 9,10-cyclo-2,4-menthanediol, also known as 1-cyclopropyl-4-methyl-1,3-cyclohexanediol, 9ci, is a member of the class of compounds known as cyclohexanols. Cyclohexanols are compounds containing an alcohol group attached to a cyclohexane ring. 9,10-cyclo-2,4-menthanediol is soluble (in water) and a very weakly acidic compound (based on its pKa). 9,10-cyclo-2,4-menthanediol can be found in pistachio, which makes 9,10-cyclo-2,4-menthanediol a potential biomarker for the consumption of this food product. C10H18O2 170.2487 170.13067982 1-cyclopropyl-4-methylcyclohexane-1,3-diol 1-cyclopropyl-4-methylcyclohexane-1,3-diol 83133-21-5 CC1CCC(O)(CC1O)C1CC1 InChI=1S/C10H18O2/c1-7-4-5-10(12,6-9(7)11)8-2-3-8/h7-9,11-12H,2-6H2,1H3 NTSNDVXMQVLQPO-UHFFFAOYSA-N belongs to the class of organic compounds known as cyclohexanols. Cyclohexanols are compounds containing an alcohol group attached to a cyclohexane ring. Cyclohexanols Organic compounds Organic oxygen compounds Organooxygen compounds Alcohols and polyols Aliphatic homomonocyclic compounds Cyclic alcohols and derivatives Hydrocarbon derivatives Tertiary alcohols Aliphatic homomonocyclic compound Cyclic alcohol Cyclohexanol Hydrocarbon derivative Tertiary alcohol logp 1.34 ALOGPS logs -0.85 ALOGPS solubility 2.41e+01 g/l ALOGPS logp 0.89 ChemAxon pka_strongest_acidic 14.32 ChemAxon pka_strongest_basic -2.9 ChemAxon iupac 1-cyclopropyl-4-methylcyclohexane-1,3-diol ChemAxon average_mass 170.2487 ChemAxon mono_mass 170.13067982 ChemAxon smiles CC1CCC(O)(CC1O)C1CC1 ChemAxon formula C10H18O2 ChemAxon inchi InChI=1S/C10H18O2/c1-7-4-5-10(12,6-9(7)11)8-2-3-8/h7-9,11-12H,2-6H2,1H3 ChemAxon inchikey NTSNDVXMQVLQPO-UHFFFAOYSA-N ChemAxon polar_surface_area 40.46 ChemAxon refractivity 47.2 ChemAxon polarizability 19.56 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 2 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 100185 Specdb::MsMs 100186 Specdb::MsMs 100187 Specdb::MsMs 165450 Specdb::MsMs 165451 Specdb::MsMs 165452 Specdb::MsMs 2794418 Specdb::MsMs 2794419 Specdb::MsMs 2794420 Specdb::MsMs 2883863 Specdb::MsMs 2883864 Specdb::MsMs 2883865 Specdb::CMs 21996 Specdb::CMs 45165 Specdb::CMs 146525 Specdb::NmrOneD 138050 Specdb::NmrOneD 138051 Specdb::NmrOneD 138052 Specdb::NmrOneD 138053 Specdb::NmrOneD 138054 Specdb::NmrOneD 138055 Specdb::NmrOneD 138056 Specdb::NmrOneD 138057 Specdb::NmrOneD 138058 Specdb::NmrOneD 138059 Specdb::NmrOneD 138060 Specdb::NmrOneD 138061 Specdb::NmrOneD 138062 Specdb::NmrOneD 138063 Specdb::NmrOneD 138064 Specdb::NmrOneD 138065 Specdb::NmrOneD 138066 Specdb::NmrOneD 138067 Specdb::NmrOneD 138068 Specdb::NmrOneD 138069 HMDB0036992 Pistachio Type 1 specific Pistacia vera 55513