1.0 2016-05-19 03:11:40 UTC 2026-08-18 02:45:06 UTC Amicarbazone SmallMolecule Amicarbazone is an organic compound with the chemical formula C10H19N5O2 and an average molecular weight of 241.29 g/mol. Amicarbazone belongs to the triazoles, a subclass of azoles within the organic compounds. It is classified within the superclass of organoheterocyclic compounds and is utilized as an industrial biocide. The compound has been identified in 25 recorded sources across several sectors. Within drinking water and water supply systems, it is found in tap water, bottled water, desalinated water, and drinking water. In aquatic systems and sediments, it is present in freshwater, seawater, surface water, and groundwater. It is also recorded in wastewater, sanitation, and biosolids, including unspecified wastewater, industrial wastewater, wastewater treatment effluent, and mine wastewater. Additionally, the compound is found in building and construction materials such as roofs, floors, and waterproofing sprays, as well as in appliances and HVAC and refrigerants, specifically water heaters and water coolers. It has also been detected in electrical and electronic equipment, including x ray tubes, television systems, magnets, and gas filled discharge tubes with solid cathode. Recorded exposure routes for amicarbazone include touch, oral, and inhalation. PMT 1H-1,2,4-Triazole-1-carboxamide, 4-amino-N-(1,1-dimethylethyl)-4,5-dihydro-3-(1-methylethyl)-5-oxo- C10H19N5O2 241.295 241.153874872 4-amino-N-tert-butyl-5-oxo-3-(propan-2-yl)-4,5-dihydro-1H-1,2,4-triazole-1-carboximidic acid 4-amino-N-tert-butyl-3-isopropyl-5-oxo-1,2,4-triazole-1-carboximidic acid 129909-90-6 CC(C)C1=NN(C(O)=NC(C)(C)C)C(=O)N1N InChI=1S/C10H19N5O2/c1-6(2)7-13-15(9(17)14(7)11)8(16)12-10(3,4)5/h6H,11H2,1-5H3,(H,12,16) ORFPWVRKFLOQHK-UHFFFAOYSA-N Organic compounds Organoheterocyclic compounds Azoles Triazoles Triazoles Azacyclic compounds Heteroaromatic compounds Hydrocarbon derivatives Organic carbonic acids and derivatives Organic oxides Organonitrogen compounds Organooxygen compounds Organopnictogen compounds Triazolines 1,2,4-triazole Aromatic heteromonocyclic compound Azacycle Carbonic acid derivative Heteroaromatic compound Hydrocarbon derivative Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Triazoline Aromatic heteromonocyclic compounds Detected and Not Quantified logp 1 logp 1.00 ALOGPS logs -2.65 ALOGPS solubility 5.35e-01 g/l ALOGPS logp 1.35 ChemAxon pka_strongest_acidic 2.08 ChemAxon pka_strongest_basic 3.08 ChemAxon iupac 4-amino-N-tert-butyl-5-oxo-3-(propan-2-yl)-4,5-dihydro-1H-1,2,4-triazole-1-carboximidic acid ChemAxon average_mass 241.295 ChemAxon mono_mass 241.153874872 ChemAxon smiles CC(C)C1=NN(C(O)=NC(C)(C)C)C(=O)N1N ChemAxon formula C10H19N5O2 ChemAxon inchi InChI=1S/C10H19N5O2/c1-6(2)7-13-15(9(17)14(7)11)8(16)12-10(3,4)5/h6H,11H2,1-5H3,(H,12,16) ChemAxon inchikey ORFPWVRKFLOQHK-UHFFFAOYSA-N ChemAxon polar_surface_area 94.52 ChemAxon refractivity 64.32 ChemAxon polarizability 25.79 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 5 ChemAxon donor_count 2 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f3bd0169ed8> 153920 135660