1.0 2016-05-22 05:11:39 UTC 2026-08-20 00:59:53 UTC Ioversol SmallMolecule Ioversol is an organic compound with the chemical formula C18H24I3N3O9. Ioversol belongs to the benzoic acids and derivatives, a subclass of benzene and substituted derivatives within the organic compounds. With an average molecular weight of 807.12 g/mol, Ioversol is a heavy molecule. This compound is found in or released from eight recorded sources. Within healthcare, pharmaceuticals, and veterinary products, it is utilized as iodinated X-ray contrast media. Other recorded sources include food preservation in food, food processing, and cookware; soap detergents and non-electric simulated smoking devices in household cleaning and consumer products; and tobacco smoke filters. Additionally, it is associated with electrical and electronic equipment, specifically electrodes, electrically stimulated smoking devices, and conductors or conductive bodies characterised by the conductive materials. Recorded exposure routes for Ioversol include intravenous, intravascular, intra-arterial, and subarachnoid administration. Human Neurotoxin C18H24I3N3O9 807.115 806.86466 N1,N3-bis(2,3-dihydroxypropyl)-5-[2-hydroxy-N-(2-hydroxyethyl)acetamido]-2,4,6-triiodobenzene-1,3-dicarboxamide ioversol 87771-40-2 OCCN(C(=O)CO)C1=C(I)C(C(=O)NCC(O)CO)=C(I)C(C(=O)NCC(O)CO)=C1I InChI=1S/C18H24I3N3O9/c19-13-11(17(32)22-3-8(29)5-26)14(20)16(24(1-2-25)10(31)7-28)15(21)12(13)18(33)23-4-9(30)6-27/h8-9,25-30H,1-7H2,(H,22,32)(H,23,33) AMDBBAQNWSUWGN-UHFFFAOYSA-N Organic compounds Benzenoids Benzene and substituted derivatives Benzoic acids and derivatives Acylaminobenzoic acid and derivatives 2-halobenzoic acids and derivatives 4-halobenzoic acids and derivatives Alkanolamines Anilides Aryl iodides Benzamides Benzoyl derivatives Carbonyl compounds Hydrocarbon derivatives Iodobenzenes Organic oxides Organoiodides Organopnictogen compounds Primary alcohols Secondary alcohols Secondary carboxylic acid amides Tertiary carboxylic acid amides Vinylogous halides 2-halobenzoic acid or derivatives 4-halobenzoic acid or derivatives Acylaminobenzoic acid or derivatives Alcohol Alkanolamine Anilide Aromatic homomonocyclic compound Aryl halide Aryl iodide Benzamide Benzoyl Carbonyl group Carboxamide group Carboxylic acid derivative Halobenzene Halobenzoic acid or derivatives Hydrocarbon derivative Iodobenzene Organic nitrogen compound Organic oxide Organic oxygen compound Organohalogen compound Organoiodide Organonitrogen compound Organooxygen compound Organopnictogen compound Primary alcohol Secondary alcohol Secondary carboxylic acid amide Tertiary carboxylic acid amide Vinylogous halide Aromatic homomonocyclic compounds Detected and Not Quantified Ioversol Metabolism SMP0126896 Ioversol Drug Metabolism Action Pathway SMP0144335 logp -2.1 logp -2.98 ALOGPS logs -2.89 ALOGPS solubility 1.04e+00 g/l ALOGPS logp -2.1 ChemAxon pka_strongest_acidic 11.72 ChemAxon pka_strongest_basic -2.6 ChemAxon iupac N1,N3-bis(2,3-dihydroxypropyl)-5-[2-hydroxy-N-(2-hydroxyethyl)acetamido]-2,4,6-triiodobenzene-1,3-dicarboxamide ChemAxon average_mass 807.115 ChemAxon mono_mass 806.86466 ChemAxon smiles OCCN(C(=O)CO)C1=C(I)C(C(=O)NCC(O)CO)=C(I)C(C(=O)NCC(O)CO)=C1I ChemAxon formula C18H24I3N3O9 ChemAxon inchi InChI=1S/C18H24I3N3O9/c19-13-11(17(32)22-3-8(29)5-26)14(20)16(24(1-2-25)10(31)7-28)15(21)12(13)18(33)23-4-9(30)6-27/h8-9,25-30H,1-7H2,(H,22,32)(H,23,33) ChemAxon inchikey AMDBBAQNWSUWGN-UHFFFAOYSA-N ChemAxon polar_surface_area 199.89 ChemAxon refractivity 144.58 ChemAxon polarizability 58.31 ChemAxon rotatable_bond_count 12 ChemAxon acceptor_count 9 ChemAxon donor_count 8 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f7225535b58> DB09134 3741 3610