1.0 2016-05-19 03:39:01 UTC 2026-08-21 23:56:50 UTC 1,2-Benzenedicarboxamide, N2-[1,1-dimethyl-2-(methylsulfonyl)ethyl]-3-iodo-N1-[2-methyl-4-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]phenyl]- SmallMolecule 1,2-Benzenedicarboxamide, N2-[1,1-dimethyl-2-(methylsulfonyl)ethyl]-3-iodo-N1-[2-methyl-4-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]phenyl]- belongs to the anilides, a subclass of benzene and substituted derivatives within the organic compounds. With an average molecular weight of 682.39 g/mol, 1,2-Benzenedicarboxamide, N2-[1,1-dimethyl-2-(methylsulfonyl)ethyl]-3-iodo-N1-[2-methyl-4-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]phenyl]- is a heavy molecule. Its chemical formula is C23H22F7IN2O4S. This compound is used as an industrial biocide. It has been identified in or released from 23 recorded sources across multiple sectors. Within the electrical and electronic equipment sector, it is found in capacitors, cell phones, batteries, printed circuit boards, wires, and cables, among four other sources. In the food, food processing, and cookware sector, it is associated with food packaging, the processing of fish, the treatment of hops, and molasses and the treatment of molasses. It is also found in the building and construction sector in floors, fencing, and tents or canopies. Other recorded sources include synthetic textiles, carpets and rugs within the textiles, leather, and furnishings sector, medical devices in the healthcare, pharmaceuticals, and veterinary products sector, and drinking water. Recorded routes of exposure for this substance include touch, inhalation, and oral. PFAS Flubendiamide N1-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-3-iodo-N2-(1-methanesulfonyl-2-methylpropan-2-yl)benzene-1,2-dicarboxamide C23H22F7IN2O4S 682.39 682.02332 2-{[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]carbamoyl}-6-iodo-N-(1-methanesulfonyl-2-methylpropan-2-yl)benzene-1-carboximidic acid 2-{[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]carbamoyl}-6-iodo-N-(1-methanesulfonyl-2-methylpropan-2-yl)benzenecarboximidic acid 272451-65-7 CC1=CC(=CC=C1NC(=O)C1=C(C(O)=NC(C)(C)CS(C)(=O)=O)C(I)=CC=C1)C(F)(C(F)(F)F)C(F)(F)F InChI=1S/C23H22F7IN2O4S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-16(12)32-18(34)14-6-5-7-15(31)17(14)19(35)33-20(2,3)11-38(4,36)37/h5-10H,11H2,1-4H3,(H,32,34)(H,33,35) ZGNITFSDLCMLGI-UHFFFAOYSA-N Organic compounds Benzenoids Benzene and substituted derivatives Anilides Benzanilides 2-halobenzoic acids and derivatives 3-halobenzoic acids and derivatives Alkyl fluorides Aryl iodides Benzamides Benzoyl derivatives Hydrocarbon derivatives Iodobenzenes Organic oxides Organofluorides Organoiodides Organonitrogen compounds Organooxygen compounds Organopnictogen compounds Secondary carboxylic acid amides Sulfones Toluenes Vinylogous halides 2-halobenzoic acid or derivatives 3-halobenzoic acid or derivatives Alkyl fluoride Alkyl halide Aromatic homomonocyclic compound Aryl halide Aryl iodide Benzamide Benzanilide Benzoic acid or derivatives Benzoyl Carboxamide group Carboxylic acid derivative Halobenzene Halobenzoic acid or derivatives Hydrocarbon derivative Iodobenzene Organic nitrogen compound Organic oxide Organic oxygen compound Organofluoride Organohalogen compound Organoiodide Organonitrogen compound Organooxygen compound Organopnictogen compound Organosulfur compound Secondary carboxylic acid amide Sulfone Sulfonyl Toluene Vinylogous halide Aromatic homomonocyclic compounds organofluorine insecticide Detected and Not Quantified logp 5.3 logp 4.71 ALOGPS logs -5.49 ALOGPS solubility 2.23e-03 g/l ALOGPS logp 5.8 ChemAxon pka_strongest_acidic 6.32 ChemAxon pka_strongest_basic 2.37 ChemAxon iupac 2-{[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]carbamoyl}-6-iodo-N-(1-methanesulfonyl-2-methylpropan-2-yl)benzene-1-carboximidic acid ChemAxon average_mass 682.39 ChemAxon mono_mass 682.02332 ChemAxon smiles CC1=CC(=CC=C1NC(=O)C1=C(C(O)=NC(C)(C)CS(C)(=O)=O)C(I)=CC=C1)C(F)(C(F)(F)F)C(F)(F)F ChemAxon formula C23H22F7IN2O4S ChemAxon inchi InChI=1S/C23H22F7IN2O4S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-16(12)32-18(34)14-6-5-7-15(31)17(14)19(35)33-20(2,3)11-38(4,36)37/h5-10H,11H2,1-4H3,(H,32,34)(H,33,35) ChemAxon inchikey ZGNITFSDLCMLGI-UHFFFAOYSA-N ChemAxon polar_surface_area 95.83 ChemAxon refractivity 137.2 ChemAxon polarizability 52.4 ChemAxon rotatable_bond_count 9 ChemAxon acceptor_count 5 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f72675bd8e0> 11193251 9368325