1.0 2016-06-03 10:46:37 UTC 2026-08-24 19:23:12 UTC methyl 2,2,3-trifluoro-3-[1,1,2,2,3,3-hexafluoro-3-(trifluoromethoxy)propoxy]propanoate SmallMolecule Methyl 2,2,3-trifluoro-3-[1,1,2,2,3,3-hexafluoro-3-(trifluoromethoxy)propoxy]propanoate is an organic compound with the formula C8H4F12O4 and an average molecular weight of 392.10 g/mol. methyl 2,2,3-trifluoro-3-[1,1,2,2,3,3-hexafluoro-3-(trifluoromethoxy)propoxy]propanoate belongs to the carboxylic acid derivatives, a subclass of carboxylic acids and derivatives within the organic compounds. This substance has been identified in or released from 32 recorded sources. These include electrical and electronic equipment such as cell phones, capacitors, batteries, printed circuit boards, and wires and cables. It is found in aquatic systems and sediments, including seawater, freshwater, surface water, and groundwater. It has also been detected in drinking water and water supply sources, specifically bottled water, tap water, and desalinated water. Additionally, the compound is present in wastewater, sanitation, and biosolids, including unspecified wastewater, industrial wastewater, mine wastewater, and wastewater treatment effluent. Other recorded sources include synthetic textiles, carpets and rugs, and agriculture and land management sectors involving irrigation water and pesticides, among 8 more sectors. Recorded exposure routes for this compound include inhalation, oral, and touch. PFAS PMT C8H4F12O4 392.097 391.991796565 methyl 2,2,3-trifluoro-3-[1,1,2,2,3,3-hexafluoro-3-(trifluoromethoxy)propoxy]propanoate methyl 2,2,3-trifluoro-3-[1,1,2,2,3,3-hexafluoro-3-(trifluoromethoxy)propoxy]propanoate 958445-54-0 COC(=O)C(F)(F)C(F)OC(F)(F)C(F)(F)C(F)(F)OC(F)(F)F InChI=1S/C8H4F12O4/c1-22-3(21)4(10,11)2(9)23-6(14,15)5(12,13)7(16,17)24-8(18,19)20/h2H,1H3 VOKIUIIBMBYXNU-UHFFFAOYSA-N Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Carboxylic acid derivatives Methyl esters Alkyl fluorides Alpha-halocarboxylic acid derivatives Carbonyl compounds Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Organofluorides Trihalomethanes Aliphatic acyclic compound Alkyl fluoride Alkyl halide Alpha-halocarboxylic acid derivative Alpha-halocarboxylic acid or derivatives Carbonyl group Halomethane Hydrocarbon derivative Methyl ester Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organofluoride Organohalogen compound Organooxygen compound Trihalomethane Aliphatic acyclic compounds Detected and Not Quantified logp 4.4 logp 4.35 ALOGPS logs -4.36 ALOGPS solubility 1.71e-02 g/l ALOGPS logp 5.09 ChemAxon pka_strongest_basic -4.7 ChemAxon iupac methyl 2,2,3-trifluoro-3-[1,1,2,2,3,3-hexafluoro-3-(trifluoromethoxy)propoxy]propanoate ChemAxon average_mass 392.097 ChemAxon mono_mass 391.991796565 ChemAxon smiles COC(=O)C(F)(F)C(F)OC(F)(F)C(F)(F)C(F)(F)OC(F)(F)F ChemAxon formula C8H4F12O4 ChemAxon inchi InChI=1S/C8H4F12O4/c1-22-3(21)4(10,11)2(9)23-6(14,15)5(12,13)7(16,17)24-8(18,19)20/h2H,1H3 ChemAxon inchikey VOKIUIIBMBYXNU-UHFFFAOYSA-N ChemAxon polar_surface_area 44.76 ChemAxon refractivity 41.78 ChemAxon polarizability 19.9 ChemAxon rotatable_bond_count 9 ChemAxon acceptor_count 3 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f3bafc66cd0> 131727912