1.0 2016-05-22 04:21:26 UTC 2026-08-19 05:36:43 UTC Prothioconazole SmallMolecule Prothioconazole is an organic compound with the chemical formula C14H15Cl2N3OS and an average molecular weight of 344.25 g/mol. Prothioconazole belongs to the halobenzenes, a subclass of benzene and substituted derivatives within the organic compounds. This compound has been identified in or released from six recorded sources. These include agriculture and land management, specifically as pesticides, as well as food, food processing, and cookware, where it is associated with the treatment of hops and the preparation of malt. Additionally, it has been detected in drinking water and water supply, and within building and construction materials such as tents, canopies, and floors. Recorded exposure routes for the substance include oral intake, inhalation, and touch. Pesticide C14H15Cl2N3OS 344.25 343.0312887 2-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-2,3-dihydro-1H-1,2,4-triazole-3-thione 2-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-1H-1,2,4-triazole-3-thione 178928-70-6 OC(CN1NC=NC1=S)(CC1=CC=CC=C1Cl)C1(Cl)CC1 InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21) MNHVNIJQQRJYDH-UHFFFAOYSA-N Organic compounds Benzenoids Benzene and substituted derivatives Halobenzenes Chlorobenzenes Alkyl chlorides Aryl chlorides Azacyclic compounds Chlorohydrins Heteroaromatic compounds Hydrocarbon derivatives Organochlorides Organonitrogen compounds Organopnictogen compounds Organosulfur compounds Tertiary alcohols Triazoles Triazolines 1,2,4-triazole Alcohol Alkyl chloride Alkyl halide Aromatic heteromonocyclic compound Aryl chloride Aryl halide Azacycle Azole Chlorobenzene Chlorohydrin Halohydrin Heteroaromatic compound Hydrocarbon derivative Organic nitrogen compound Organic oxygen compound Organochloride Organohalogen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Organosulfur compound Tertiary alcohol Triazoline Aromatic heteromonocyclic compounds Conazole fungicides cyclopropanes monochlorobenzenes tertiary alcohol thiocarbonyl compound triazoles Detected and Not Quantified logp 2.7 logp 2.34 ALOGPS logs -4.41 ALOGPS solubility 1.34e-02 g/l ALOGPS logp 2.78 ChemAxon pka_strongest_acidic 9.62 ChemAxon pka_strongest_basic 0.58 ChemAxon iupac 2-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-2,3-dihydro-1H-1,2,4-triazole-3-thione ChemAxon average_mass 344.25 ChemAxon mono_mass 343.0312887 ChemAxon smiles OC(CN1NC=NC1=S)(CC1=CC=CC=C1Cl)C1(Cl)CC1 ChemAxon formula C14H15Cl2N3OS ChemAxon inchi InChI=1S/C14H15Cl2N3OS/c15-11-4-2-1-3-10(11)7-14(20,13(16)5-6-13)8-19-12(21)17-9-18-19/h1-4,9,20H,5-8H2,(H,17,18,21) ChemAxon inchikey MNHVNIJQQRJYDH-UHFFFAOYSA-N ChemAxon polar_surface_area 47.86 ChemAxon refractivity 98.45 ChemAxon polarizability 32.9 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 3 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f72242db228> 6451142 4953623