1.0 2010-04-08 22:05:03 UTC 2025-11-18 22:32:24 UTC FDB001658 2-Isopropylcyclopentanone 2-isopropylcyclopentanone is a member of the class of compounds known as cyclic ketones. Cyclic ketones are organic compounds containing a ketone that is conjugated to a cyclic moiety. 2-isopropylcyclopentanone is slightly soluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). 2-isopropylcyclopentanone can be found in cornmint, which makes 2-isopropylcyclopentanone a potential biomarker for the consumption of this food product. C8H14O 126.1962 126.10446507 2-(propan-2-yl)cyclopentan-1-one 2-isopropylcyclopentan-1-one 14845-55-7 CC(C)C1CCCC1=O InChI=1S/C8H14O/c1-6(2)7-4-3-5-8(7)9/h6-7H,3-5H2,1-2H3 RKZBBVUTJFJAJR-UHFFFAOYSA-N belongs to the class of organic compounds known as cyclic ketones. These are organic compounds containing a ketone that is conjugated to a cyclic moiety. Cyclic ketones Organic compounds Organic oxygen compounds Organooxygen compounds Carbonyl compounds Aliphatic homomonocyclic compounds Hydrocarbon derivatives Organic oxides Aliphatic homomonocyclic compound Cyclic ketone Hydrocarbon derivative Organic oxide logp 1.95 ALOGPS logs -1.53 ALOGPS solubility 3.76e+00 g/l ALOGPS logp 2.32 ChemAxon pka_strongest_basic -7.4 ChemAxon iupac 2-(propan-2-yl)cyclopentan-1-one ChemAxon average_mass 126.1962 ChemAxon mono_mass 126.10446507 ChemAxon smiles CC(C)C1CCCC1=O ChemAxon formula C8H14O ChemAxon inchi InChI=1S/C8H14O/c1-6(2)7-4-3-5-8(7)9/h6-7H,3-5H2,1-2H3 ChemAxon inchikey RKZBBVUTJFJAJR-UHFFFAOYSA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 37.37 ChemAxon polarizability 15.07 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 53232 Specdb::MsMs 53233 Specdb::MsMs 53234 Specdb::MsMs 166509 Specdb::MsMs 166510 Specdb::MsMs 166511 Specdb::MsMs 3598013 Specdb::MsMs 3598014 Specdb::MsMs 3598015 Specdb::MsMs 3598016 Specdb::MsMs 3598017 Specdb::MsMs 3598018 Cornmint Type 1 specific Mentha arvensis 292239