1.0 2010-04-08 22:09:24 UTC 2019-11-26 03:04:25 UTC FDB010984 2-Undecyl-4(1H)-quinolinone N-oxide Isolated from roots of Ruta graveolens (rue). 2-Undecyl-4(1H)-quinolinone N-oxide is found in herbs and spices. 2-Undecyl-4(1H)-quinolinone N-oxide C20H28NO2 314.4418 314.212004145 1,4-dioxo-2-undecyl-1,4-dihydro-1λ⁵-quinolin-1-yl 1,4-dioxo-2-undecyl-1H-1λ⁵-quinolin-1-yl 2503-86-8 CCCCCCCCCCCC1=CC(=O)C2=C(C=CC=C2)[N]1=O InChI=1S/C20H29NO2/c1-2-3-4-5-6-7-8-9-10-13-17-16-20(22)18-14-11-12-15-19(18)21(17)23/h11-12,14-16,21H,2-10,13H2,1H3 PVFSIEJKJIGBCQ-UHFFFAOYSA-N belongs to the class of organic compounds known as hydroquinolones. Hydroquinolones are compounds containing a hydrogenated quinoline bearing a ketone group. Hydroquinolones Organic compounds Organoheterocyclic compounds Quinolines and derivatives Quinolones and derivatives Aromatic heteropolycyclic compounds Aryl ketones Azacyclic compounds Benzenoids Disubstituted amine oxides and derivatives Hydrocarbon derivatives Hydroquinolines Organic oxides Organic zwitterions Organopnictogen compounds Aromatic heteropolycyclic compound Aryl ketone Azacycle Benzenoid Dihydroquinoline Dihydroquinolone Disubstituted n-oxide Hydrocarbon derivative Ketone N-oxide Organic nitrogen compound Organic oxide Organic oxygen compound Organic zwitterion Organonitrogen compound Organooxygen compound Organopnictogen compound logp 4.88 ALOGPS logs -6.00 ALOGPS solubility 3.17e-04 g/l ALOGPS melting_point Mp 148.5-149.5° pka_strongest_acidic 13.6 ChemAxon pka_strongest_basic 0.098 ChemAxon iupac 1,4-dioxo-2-undecyl-1,4-dihydro-1λ⁵-quinolin-1-yl ChemAxon average_mass 314.4418 ChemAxon mono_mass 314.212004145 ChemAxon smiles CCCCCCCCCCCC1=CC(=O)C2=C(C=CC=C2)[N]1=O ChemAxon formula C20H28NO2 ChemAxon inchi InChI=1S/C20H29NO2/c1-2-3-4-5-6-7-8-9-10-13-17-16-20(22)18-14-11-12-15-19(18)21(17)23/h11-12,14-16,21H,2-10,13H2,1H3 ChemAxon inchikey PVFSIEJKJIGBCQ-UHFFFAOYSA-N ChemAxon polar_surface_area 53.35 ChemAxon refractivity 106.25 ChemAxon polarizability 38.49 ChemAxon rotatable_bond_count 10 ChemAxon acceptor_count 0 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon HMDB32995 #<Reference:0x000055ce320f0d10> Herbs and Spices Unknown generic