1.0 2016-05-25 02:59:35 UTC 2026-05-14 19:47:05 UTC Phytic acid SmallMolecule Phytic acid (C6H18O24P6) is a chemical compound used as an industrial chelating agent and a biological antioxidant (PMC12483449, PMC5535845). It also serves as an industrial flame retardant (PMC7023565). Phytic acid belongs to the alcohols and polyols, a subclass of organooxygen compounds within the organic compounds. With an average molecular weight of 660.04 g/mol, Phytic acid is a heavy molecule. The compound is found in or released from 33 recorded sources. Within electrical and electronic equipment, it is associated with antennas, communication cables or conductors, electric switches, cores yokes or armatures, and conductors or conductive bodies characterised by the conductive materials, among 9 others. In the category of household cleaning and consumer products, it is found in bleaching agents, perfumes within detergents and soaps, cigar cigarettes, non electric simulated smoking devices, other smoking requisites, and 4 others. Its presence in food, food processing and cookware includes the preparation of malt, the preparation of vinegar, fermentation processes for beer, food preservation, the preparation of wine or sparkling wine, and 3 others. Additionally, it is recorded in building and construction materials such as ceilings, as well as in household items including watch chains. 1D-myo-inositol 1,2,3,4,5,6-hexakisphosphate Myo-inositol hexakisphosphate C6H18O24P6 660.0353 659.861370576 {[2,3,4,5,6-pentakis(phosphonooxy)cyclohexyl]oxy}phosphonic acid phytic acid 83-86-3 OP(O)(=O)OC1C(OP(O)(O)=O)C(OP(O)(O)=O)C(OP(O)(O)=O)C(OP(O)(O)=O)C1OP(O)(O)=O InChI=1S/C6H18O24P6/c7-31(8,9)25-1-2(26-32(10,11)12)4(28-34(16,17)18)6(30-36(22,23)24)5(29-35(19,20)21)3(1)27-33(13,14)15/h1-6H,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)(H2,19,20,21)(H2,22,23,24) IMQLKJBTEOYOSI-UHFFFAOYSA-N Organic compounds Organic oxygen compounds Organooxygen compounds Alcohols and polyols Inositol phosphates Hydrocarbon derivatives Monoalkyl phosphates Organic oxides Aliphatic homomonocyclic compound Alkyl phosphate Hydrocarbon derivative Inositol phosphate Monoalkyl phosphate Organic oxide Organic phosphoric acid derivative Phosphoric acid ester Aliphatic homomonocyclic compounds Detected and Not Quantified Inositol Metabolism SMP0000011 Inositol Phosphate Metabolism SMP0000462 logp -4.5 logp 0.11 ALOGPS logs -1.68 ALOGPS solubility 1.37e+01 g/l ALOGPS logp -4.5 ChemAxon pka_strongest_acidic 0.14 ChemAxon iupac {[2,3,4,5,6-pentakis(phosphonooxy)cyclohexyl]oxy}phosphonic acid ChemAxon average_mass 660.0353 ChemAxon mono_mass 659.861370576 ChemAxon smiles OP(O)(=O)OC1C(OP(O)(O)=O)C(OP(O)(O)=O)C(OP(O)(O)=O)C(OP(O)(O)=O)C1OP(O)(O)=O ChemAxon formula C6H18O24P6 ChemAxon inchi InChI=1S/C6H18O24P6/c7-31(8,9)25-1-2(26-32(10,11)12)4(28-34(16,17)18)6(30-36(22,23)24)5(29-35(19,20)21)3(1)27-33(13,14)15/h1-6H,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)(H2,19,20,21)(H2,22,23,24) ChemAxon inchikey IMQLKJBTEOYOSI-UHFFFAOYSA-N ChemAxon polar_surface_area 400.56 ChemAxon refractivity 101.01 ChemAxon polarizability 42.71 ChemAxon rotatable_bond_count 12 ChemAxon acceptor_count 18 ChemAxon donor_count 12 ChemAxon physiological_charge -12 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f7224338d60> DB14981 890