1.0 2016-06-03 10:38:12 UTC 2026-08-19 16:12:49 UTC 4,4-Difluoro-N-[(1S)-3-oxo-1-phenylpropyl]cyclohexanecarboxamide SmallMolecule 4,4-Difluoro-N-[(1S)-3-oxo-1-phenylpropyl]cyclohexanecarboxamide belongs to the cyclohexyl halides, a subclass of alkyl halides within the organic compounds. This compound has the chemical formula C16H19F2NO2 and an average molecular weight of 295.33 g/mol. It has been found in or released from one recorded source: drinking water and water supply (drinking water). The recorded exposure route for this substance is oral. C16H19F2NO2 295.33 295.138385182 4,4-difluoro-N-(3-oxo-1-phenylpropyl)cyclohexane-1-carboximidic acid 4,4-difluoro-N-(3-oxo-1-phenylpropyl)cyclohexane-1-carboximidic acid 376348-78-6 OC(=NC(CC=O)C1=CC=CC=C1)C1CCC(F)(F)CC1 InChI=1S/C16H19F2NO2/c17-16(18)9-6-13(7-10-16)15(21)19-14(8-11-20)12-4-2-1-3-5-12/h1-5,11,13-14H,6-10H2,(H,19,21) FCEMFOOGKQYYIR-UHFFFAOYSA-N Organic compounds Organohalogen compounds Alkyl halides Cyclohexyl halides Cyclohexyl halides Alkyl fluorides Alpha-hydrogen aldehydes Benzene and substituted derivatives Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds Organopnictogen compounds Secondary carboxylic acid amides Aldehyde Alkyl fluoride Alpha-hydrogen aldehyde Aromatic homomonocyclic compound Benzenoid Carbonyl group Carboxamide group Carboxylic acid derivative Cyclohexyl halide Hydrocarbon derivative Monocyclic benzene moiety Organic nitrogen compound Organic oxide Organic oxygen compound Organofluoride Organonitrogen compound Organooxygen compound Organopnictogen compound Secondary carboxylic acid amide Aromatic homomonocyclic compounds Detected and Not Quantified logp 2.3 logp 2.73 ALOGPS logs -3.97 ALOGPS solubility 3.17e-02 g/l ALOGPS logp 2.95 ChemAxon pka_strongest_acidic 5.37 ChemAxon pka_strongest_basic 2.82 ChemAxon iupac 4,4-difluoro-N-(3-oxo-1-phenylpropyl)cyclohexane-1-carboximidic acid ChemAxon average_mass 295.33 ChemAxon mono_mass 295.138385182 ChemAxon smiles OC(=NC(CC=O)C1=CC=CC=C1)C1CCC(F)(F)CC1 ChemAxon formula C16H19F2NO2 ChemAxon inchi InChI=1S/C16H19F2NO2/c17-16(18)9-6-13(7-10-16)15(21)19-14(8-11-20)12-4-2-1-3-5-12/h1-5,11,13-14H,6-10H2,(H,19,21) ChemAxon inchikey FCEMFOOGKQYYIR-UHFFFAOYSA-N ChemAxon polar_surface_area 49.66 ChemAxon refractivity 75.82 ChemAxon polarizability 29.42 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 3 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f722748b688> 9879220 8054897