1.0 2010-04-08 22:08:44 UTC 2018-05-28 23:25:07 UTC FDB009651 Isopropyl citrate It is used as a food additive . 1-Methylethyl 2-hydroxy-1,2,3-propanetricarboxylate Citric acid, isopropyl ester Visicol C10H18O7 250.2457 250.10525293 2-hydroxy-2-(2-oxopropyl)butanedioic acid; propan-2-ol 2-hydroxy-2-(2-oxopropyl)butanedioic acid; isopropyl alcohol 39413-05-3 CC(C)O.CC(=O)CC(O)(CC(O)=O)C(O)=O InChI=1S/C7H10O6.C3H8O/c1-4(8)2-7(13,6(11)12)3-5(9)10;1-3(2)4/h13H,2-3H2,1H3,(H,9,10)(H,11,12);3-4H,1-2H3 XBLJCYOUYPSETL-UHFFFAOYSA-N belongs to the class of organic compounds known as medium-chain keto acids and derivatives. These are keto acids with a 6 to 12 carbon atoms long side chain. Medium-chain keto acids and derivatives Organic compounds Organic acids and derivatives Keto acids and derivatives Medium-chain keto acids and derivatives Alpha hydroxy acids and derivatives Beta-hydroxy ketones Branched fatty acids Carboxylic acids Dicarboxylic acids and derivatives Gamma-keto acids and derivatives Hydrocarbon derivatives Hydroxy fatty acids Organic oxides Secondary alcohols Tertiary alcohols Alcohol Aliphatic acyclic compound Alpha-hydroxy acid Beta-hydroxy ketone Branched fatty acid Carbonyl group Carboxylic acid Carboxylic acid derivative Dicarboxylic acid or derivatives Fatty acyl Gamma-keto acid Hydrocarbon derivative Hydroxy acid Hydroxy fatty acid Ketone Medium-chain keto acid Organic oxide Organic oxygen compound Organooxygen compound Secondary alcohol Tertiary alcohol logp -0.99 ChemAxon pka_strongest_acidic 3.32 ChemAxon pka_strongest_basic -4.1 ChemAxon iupac 2-hydroxy-2-(2-oxopropyl)butanedioic acid; propan-2-ol ChemAxon average_mass 250.2457 ChemAxon mono_mass 250.10525293 ChemAxon smiles CC(C)O.CC(=O)CC(O)(CC(O)=O)C(O)=O ChemAxon formula C10H18O7 ChemAxon inchi InChI=1S/C7H10O6.C3H8O/c1-4(8)2-7(13,6(11)12)3-5(9)10;1-3(2)4/h13H,2-3H2,1H3,(H,9,10)(H,11,12);3-4H,1-2H3 ChemAxon inchikey XBLJCYOUYPSETL-UHFFFAOYSA-N ChemAxon polar_surface_area 111.9 ChemAxon refractivity 39.18 ChemAxon polarizability 16.53 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 6 ChemAxon donor_count 3 ChemAxon physiological_charge -2 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 42815 Specdb::MsMs 98835 Specdb::MsMs 98836 Specdb::MsMs 98837 Specdb::MsMs 163845 Specdb::MsMs 163846 Specdb::MsMs 163847 HMDB32353 #<Reference:0x000055ce32de2708>